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14 ноября 2024 г.
A low copper content alloy Al_(1-x)Cu_x, x≤0.1: a joint computational and experimental study.

M.A. Frolov, E.M. Dvoryanova, A.F. Krutov, V.E. Pavlova, A.V. Burchakov, V.A. Novikov, O.A. Blatova, A.V. Sokolov, A.P. Zentsov, V.Yu. Sorokin, A.N. Gataullin, S.S. Petrov, M.O. Kudryashova, A.A. Kabanov, V.A. Blatov A low copper content alloy Al_(1-x)Cu_x, x≤0.1: a joint computational and experimental study. Physica B: Condensed Matter, 2024, 416741. doi: 10.1016/j.physb.2024.416741 IF 2.8

Метки: Aleksandr V. Burchakov, Alexander F. Krutov, Artem A. Kabanov, Michail A. Frolov, Olga A. Blatova, Q2, Samara Branch of LPI RAS, Samara State Technical University, Valeria E. Pavlova, Vladislav A. Blatov

31 октября 2024 г.
The extended investigation of the conductive characteristics of monoclinic tungstates with the Bi_3.24Ln₂W_0.76O_10.14 (Ln = La, Pr or Nd) composition.

Ekaterina Orlova, Yelizaveta A. Morkhova, Nikolay Viktorovich Lyskov, Anastasia Egorova, Egor Baldin, Artem A Kabanov, Elena Kharitonova and V. I. Voronkova The extended investigation of the conductive characteristics of monoclinic tungstates with the Bi_3.24Ln₂W_0.76O_10.14 (Ln = La, Pr or Nd) composition. Dalton Transactions, 2024, 53 (48), 19403–19411. doi: 10.1039/D4DT02462A IF 3.5

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Yelizaveta A. Morkhova

28 октября 2024 г.
When topology meets geometry: topological motifs and uniformity of atomic sublattices in inorganic crystals.

Inna V. Medrish and Vladislav A. Blatov When topology meets geometry: topological motifs and uniformity of atomic sublattices in inorganic crystals. CrystEngComm, 2024, 26 (45), 6410–6419. doi: 10.1039/D4CE01009D IF 2.6

Метки: Inna V. Medrish, Q2, Samara State Technical University, Vladislav A. Blatov

23 октября 2024 г.
The “reaction zone” concept in modeling solid-state transformations and predicting crystal structures.

Ekaterina O. Bukhteeva & Vladislav A. Blatov The “reaction zone” concept in modeling solid-state transformations and predicting crystal structures. Structural Chemistry, 2024. doi: 10.1007/s11224-024-02402-5 IF 2.1

Метки: Ekaterina О. Bukhteeva, Q3, Samara State Technical University, Vladislav A. Blatov

14 октября 2024 г.
Stability of inorganic ionic structures: the uniformity approach.

A. P. Shevchenko and V. A. Blatov Stability of inorganic ionic structures: the uniformity approach. Acta Crystallographica Section A, 2024, А80 (6), 446-456. doi: 10.1107/S2053273324009008 IF 2.1

Метки: Alexander P. Shevchenko, Q2, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov

9 сентября 2024 г.
Topology of Intermetallic Crystals: Classification, Uniformity, and Transitions.

Olga A. Blatova, Tikhon D. Slavnov, Anastasiya D. Afanasieva, Alexei M. Grebennikov, Vladislav A. Blatov Topology of Intermetallic Crystals: Classification, Uniformity, and Transitions. Inorganic Chemistry, 2024, 63 (38), 17881–17890. doi: 10.1021/acs.inorgchem.4c03033 IF 4.3

Метки: Anastasiya D. Afanasieva, Olga A. Blatova, Q1, Samara State Technical University, Tikhon D. Slavnov, Vladislav A. Blatov

9 сентября 2024 г.
Topological relations between crystal structures: a route to predicting inorganic materials.

Natalia A. Kabanova, Ekaterina A. Grishina, Vladislav T. Osipov, Valeria E. Pavlova, Maria A. Solodovnikova, Artem A. Kabanov & Vladislav A. Blatov Topological relations between crystal structures: a route to predicting inorganic materials. Structural Chemistry, 2024, 35 (6), 1793–1803. doi: 10.1007/s11224-024-02379-1 IF 2.1

Метки: Artem A. Kabanov, Maria A. Solodovnikova, Natalya A. Kabanova, Q3, Samara Branch of LPI RAS, Samara State Technical University, Valeria E. Pavlova, Vladislav A. Blatov, Vladislav T. Osipov

28 августа 2024 г.
Extended Modeling and Experimental Study of the Li⁺-Ionic Conductivity in Li_1.5+xAl_0.5Ge_1.5Si_xP_3–xO₁₂, x = 0; 0.1.

Svetlana V. Pershina, Yelizaveta A. Morkhova, Artem A. Kabanov, Kirill S. Okhotnikov, Eugene A. Filippov, Vladimir A. Elterman, Tamara A. Kuznetsova, Vladimir I. Voronin, George N. Starostin Extended Modeling and Experimental Study of the Li⁺-Ionic Conductivity in Li_1.5+xAl_0.5Ge_1.5Si_xP_3–xO₁₂, x = 0; 0.1. The Journal of Physical Chemistry C, 2024, 128 (36), 14871–14879. doi: 10.1021/acs.jpcc.4c02613 IF 3.3

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Yelizaveta A. Morkhova

18 июля 2024 г.
Migration paths of the Na⁺-ion diffusion for minerals of the lovozerite group: crystallochemical and DFT modeling.

Natalia A. Kabanova Migration paths of the Na⁺-ion diffusion for minerals of the lovozerite group: crystallochemical and DFT modeling. CrystEngComm, 2024, 26 (31), 4156–4166. doi: 10.1039/D4CE00545G IF 2.6

Метки: Natalya A. Kabanova, Q2, Samara State Technical University

17 июля 2024 г.
A Sodium Germanosilicide with Unusual Network Topology.

Julia-Maria Hübner, Thomas B. Shiell, Piotr A. Guńka, Shuo Tao, Li Zhu, Mads Fonager Hansen, Emma S. Bullock, Stella Chariton, Vitali B. Prakapenka, Yingwei Fei, Vladislav A. Blatov, Davide M. Proserpio, and Timothy A. Strobel A Sodium Germanosilicide with Unusual Network Topology. Journal of the American Chemical Society, 2024, 146 (30), 20544–20549. doi: 10.1021/jacs.4c03960 IF 16.383

Метки: Davide M. Proserpio, Q1, Samara State Technical University, Vladislav A. Blatov

15 июня 2024 г.
High-throughput search for new solid-state sodium-conducting materials among polyanionic oxides.

Yelizaveta A. Morkhova, Alexander V. Antonyuk & Irina A. Naugolnova High-throughput search for new solid-state sodium-conducting materials among polyanionic oxides. Journal of Solid State Electrochemistry, 2024, 28 (10), 3665–3671. doi: 10.1007/s10008-024-05965-9 IF 2.5

Метки: Alexander V. Antonyuk, Q2, Samara State Technical University, Yelizaveta A. Morkhova

4 июня 2024 г.
A set of new promising solid chalcogenides for Na-ion batteries: yield from the crystal chemical, Monte-Carlo and quantum-chemical calculations.

Yelizaveta A. Morkhova, Alexander V. Antonyuk, Artem A. Kabanov, Vladislav A. Blatov A set of new promising solid chalcogenides for Na-ion batteries: yield from the crystal chemical, Monte-Carlo and quantum-chemical calculations. ChemPhysChem, 2024, 25 (18), e202400067. doi: 10.1002/cphc.202400067 IF 3.181

Метки: Alexander V. Antonyuk, Artem A. Kabanov, Q2, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov, Yelizaveta A. Morkhova

25 апреля 2024 г.
Exhaustive Study of Electrical Conductivity in the MNb_2-xTi_xO_6-0.5x (M = Mg, Ca, Zn; x = 0, 0.1, 0.2) Columbite.

Yelizaveta Morkhova, Mariia Koroleva, Anastasia Egorova, Aleksei Krasnov, Inna Starostina and Artem Kabanov Exhaustive Study of Electrical Conductivity in the MNb_2-xTi_xO_6-0.5x (M = Mg, Ca, Zn; x = 0, 0.1, 0.2) Columbites. ECS Advances, 2024, 3 (2), 024504. doi: 10.1149/2754-2734/ad3f31

Метки: Artem A. Kabanov, Samara State Technical University, Yelizaveta A. Morkhova

25 марта 2024 г.
Machine Learning As a Tool to Accelerate the Search for New Materials for Metal-Ion Batteries.

V. T. Osipov, M. I. Gongola, Ye. A. Morkhova, A. P. Nemudryi & A. A. Kabanov Machine Learning As a Tool to Accelerate the Search for New Materials for Metal-Ion Batteries. Doklady Mathematics, 2023, 108 (Suppl 2), S476–S483. doi: 10.1134/S1064562423701612 IF 0.6

Метки: Artem A. Kabanov, Q2, Samara State Technical University, Vladislav T. Osipov, Yelizaveta A. Morkhova

22 марта 2024 г.
Comprehensive study of the synthetic tychite, Na₆Mg₂(CO₃)₄SO₄: synthesis, structure and conductive properties.

Alexander A. Shindrov and Yelizaveta A. Morkhova Comprehensive study of the synthetic tychite, Na₆Mg₂(CO₃)₄SO₄: synthesis, structure and conductive properties. Dalton Transactions, 2024, 53 (15), 6618–6624. doi: 10.1039/D4DT00396A IF 4.0

Метки: Q1, Samara State Technical University, Yelizaveta A. Morkhova

24 февраля 2024 г.
Extensive research of conductivity in the fluorite-like KLn₄Mo₃O₁₅F (Ln = La, Pr, Nd) rare earth molybdates: theoretical and experimental data.

Ekaterina I. Orlova, Yelizaveta A. Morkhova, Anastasia V. Egorova, Artem A. Kabanov, Egor D. Baldin, Elena P. Kharitonova, Nikolay V. Lyskov, Vasiliy O. Yapaskurt, Olga A. Alekseeva, Valentina I. Voronkova and Daniil V. Korona Extensive research of conductivity in the fluorite-like KLn₄Mo₃O₁₅F (Ln = La, Pr, Nd) rare earth molybdates: theoretical and experimental data. Physical Chemistry Chemical Physics, 2024, 26 (9), 7772–7782. doi: 10.1039/D3CP06134E IF 3.3

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Yelizaveta A. Morkhova

19 февраля 2024 г.
Theoretical study of the oxygen ion conductivity and modeling new hollandite-type structures LnM₆O₁₂ (Ln = Pr, Nd; M = Ti, Nb, Mo).

Natalia A. Kabanova Theoretical study of the oxygen ion conductivity and modeling new hollandite-type structures LnM₆O₁₂ (Ln = Pr, Nd; M = Ti, Nb, Mo). Computational and Theoretical Chemistry, 2024, 1234, 114516. doi: 10.1016/j.comptc.2024.114516 IF 2.8

Метки: Natalya A. Kabanova, Q3, Samara State Technical University

1 февраля 2024 г.
A redox active rod coordination polymer from tetrakis(4-carboxylic acid biphenyl)tetrathiafulvalene.

Nicolas Zigon, Federica Solano, Pascale Auban-Senzier, Stéphane Grolleau, Thomas Devic, Pavel N. Zolotarev, Davide M. Proserpio, Bolesław Barszcz, Iwona Olejniczak and Narcis Avarvari A redox active rod coordination polymer from tetrakis(4-carboxylic acid biphenyl)tetrathiafulvalene. Dalton Transactions, 2024, 53 (10), 4805–4813. doi: 10.1039/D3DT04280D IF 4.0

Метки: Davide M. Proserpio, Q1

24 января 2024 г.
Mechanical properties of porous materials based on new triply periodic and minimal surfaces.

Anton V. Eremin, Michael A. Frolov, Alexander F. Krutov, Michael I. Smolkov, Alexander S. Shulga, Dmitry M. Bragin, Andrey I. Popov & Vladislav A. Blatov Mechanical properties of porous materials based on new triply periodic and minimal surfaces. Mechanics of Advanced Materials and Structures, 2024, 31(29), 11320–11336. doi: 10.1080/15376494.2024.2303724 IF 3.338

Метки: Alexander F. Krutov, Michail A. Frolov, Michail I. Smolkov, Q2, Samara State Technical University, Vladislav A. Blatov

18 января 2024 г.
Topological Analysis and Structural Role of Silicon Motifs in Metal Silicides.

Inna V. Medrish, Maria A. Solodovnikova, Artem A. Kabanov, and Vladislav A. Blatov Topological Analysis and Structural Role of Silicon Motifs in Metal Silicides. Crystal Growth & Design, 2024, 24 (3), 1308–1318. doi: 10.1021/acs.cgd.3c01282 IF 3.8

Метки: Artem A. Kabanov, Inna V. Medrish, Maria A. Solodovnikova, Q2, Samara State Technical University, Vladislav A. Blatov

29 декабря 2023 г.
An Octacarboxylate-Linked Sodium Metal–Organic Framework with High Porosity.

Jiafeng Miao, Wells Graham, Jiaqi Liu, Ena Clementine Hill, Lu-Lu Ma, Saif Ullah, Hai-Lun Xia, Fu-An Guo, Timo Thonhauser, Davide M. Proserpio, Jing Li, and Hao Wang An Octacarboxylate-Linked Sodium Metal–Organic Framework with High Porosity. Journal of the American Chemical Society, 2024, 146 (1), 84–88. doi: 10.1021/jacs.3c11260 IF 15.0

Метки: Davide M. Proserpio, Q1

25 декабря 2023 г.
The AM-4 Family of Layered Titanosilicates: Single-Crystal-to-Single-Crystal Transformation, Synthesis and Ionic Conductivity.

Galina O. Kalashnikova, Sergey V. Krivovichev, Victor N. Yakovenchuk, Ekaterina A. Selivanova, Margarita S. Avdontсeva, Gregory Yu. Ivanyuk, Yakov A. Pakhomovsky, Darya V. Gryaznova, Natalya A. Kabanova, Yelizaveta A. Morkhova, Olga Yu. Sinel’shchikova, Vladimir N. Bocharov, Anatoly I. Nikolaev, Olga F. Goychuk, Sergei N. Volkov and Taras L. Panikorovskii The AM-4 Family of Layered Titanosilicates: Single-Crystal-to-Single-Crystal Transformation, Synthesis and Ionic Conductivity. Materials, 2024, 17(1), 111. doi: 10.3390/ma17010111 IF 3.4

Метки: Natalya A. Kabanova, Q2, Samara State Technical University, Yelizaveta A. Morkhova

23 декабря 2023 г.
High-throughput screening of oxygen ion conductors with Ba_aX_bO_c and Sr_dY_eO_f compositions: Crystallochemical and DFT-calculations.

Natalia A. Kabanova, Marya A. Galstyan, Eugeny I. Frolov High-throughput screening of oxygen ion conductors with Ba_aX_bO_c and Sr_dY_eO_f compositions: Crystallochemical and DFT-calculations. Solid State Ionics, 2024, 405, 116423. doi: 10.1016/j.ssi.2023.116423 IF 3.2

Метки: Eugeny I. Frolov, Natalya A. Kabanova, Q2, Samara State Technical University

21 декабря 2023 г.
The effect of lithium sources and thermal treatment on the structure and electrochemistry of Li_1.2Ti_0.4Mn_0.4O₂ and Li_1.3Nb_0.3Mn_0.4O₂ cathodes.

Olga A. Podgornova, Kseniya V. Mishchenko, Maria A. Kirsanova, Daria O. Semykina, Yelizaveta A. Morkhova & Nina V. Kosova The effect of lithium sources and thermal treatment on the structure and electrochemistry of Li_1.2Ti_0.4Mn_0.4O₂ and Li_1.3Nb_0.3Mn_0.4O₂ cathodes. Journal of Solid State Electrochemistry, 2024, 28 (7), 2351–2362. doi: 10.1007/s10008-023-05781-7 IF 2.5

Метки: Q2, Samara State Technical University, Yelizaveta A. Morkhova

15 декабря 2023 г.
A Novel Class of Multivalent Ionic Conductors of the La₃CuSiS₇ Structure Type: the Results of Stepwise ICSD Screening.

Artem A. Kabanov, Yelizaveta A. Morkhova, Vladislav Osipov, Manuel Rothenberger, Tilmann Leisegang and Vladislav A. Blatov A Novel Class of Multivalent Ionic Conductors of the La₃CuSiS₇ Structure Type: the Results of Stepwise ICSD Screening. Physical Chemistry Chemical Physics, 2024, 26 (3), 2622–2628. doi: 10.1039/D3CP04510B IF 3.3

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov, Vladislav T. Osipov, Yelizaveta A. Morkhova

11 декабря 2023 г.
Rational Design and Reticulation of Infinite qbe Rod Secondary Building Units into Metal–Organic Frameworks through a Global Desymmetrization Approach for Inverse C₃H₈/C₃H₆ Separation.

Wei Gong, Yi Xie, Akihito Yamano, Sho Ito, Eric W. Reinheimer, Jinqiao Dong, Christos D. Malliakas, Davide M. Proserpio, Yong Cui, Omar K. Farha Rational Design and Reticulation of Infinite qbe Rod Secondary Building Units into Metal–Organic Frameworks through a Global Desymmetrization Approach for Inverse C₃H₈/C₃H₆ Separation. Angewandte Chemie, 2024, 63(5), e202318475. doi: 10.1002/anie.202318475 IF 16.823

Метки: Davide M. Proserpio, Q1

22 ноября 2023 г.
Stability of intermetallic compounds: Geometrical and topological aspects.

Olga A. Blatova, Maria A. Solodovnikova, Ekaterina M. Egorova, Vladislav A. Blatov Stability of intermetallic compounds: Geometrical and topological aspects. Intermetallics, 2024, 164, 108124. doi: 10.1016/j.intermet.2023.108124 IF 4.4

Метки: Maria A. Solodovnikova, Olga A. Blatova, Q1, Samara State Technical University, Vladislav A. Blatov

14 ноября 2023 г.
Hierarchical topological analysis of crystal structures: the skeletal net concept.

Blatova O. A. and Blatov V. A. Hierarchical topological analysis of crystal structures: the skeletal net concept. Acta Crystallographica Section A, 2024, 80 (1), 65–71. doi:10.1107/S2053273323008975 IF 2.290

Метки: Olga A. Blatova, Q1, Samara State Technical University, Vladislav A. Blatov

27 октября 2023 г.
Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers.

Borja Ortín-Rubio, Jaume Rostoll-Berenguer, Carlos Vila, Davide M. Proserpio, Vincent Guillerm, Judith Juanhuix, Inhar Imaz and Daniel Maspoch Net-clipping as a top-down approach for the prediction of topologies of MOFs built from reduced-symmetry linkers. Chemical Science, 2023, 14, 12984–12994. doi: 10.1039/d3sc04406h IF 8.4

Метки: Davide M. Proserpio, Q1

27 октября 2023 г.
Theoretical and Experimental Study of the Structure and Electrochemical Properties of V-Doped TiNb₂O₇ Anode for Lithium-Ion Batteries.

Dmitry Z. Tsydypylov, Artem A. Kabanov, Yelizaveta A. Morkhova, Kirill S. Okhotnikov, and Nina V. Kosova Theoretical and Experimental Study of the Structure and Electrochemical Properties of V-Doped TiNb₂O₇ Anode for Lithium-Ion Batteries. The Journal of Physical Chemistry C, 2023, 127 (44), 21829–21840. doi: 10.1021/acs.jpcc.3c05633 IF 3.7

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Yelizaveta A. Morkhova

19 августа 2023 г.
First Finding of High-Pressure Modifications of Na₂CO₃ and K₂CO₃ with sp³-Hybridized Carbon Atoms.

Pavel N. Gavryushkin, Nursultan E. Sagatov, Dinara N. Sagatova, Altyna Bekhtenova, Maksim V. Banaev, Eugeny V. Alexandrov, and Konstantin D. Litasov First Finding of High-Pressure Modifications of Na₂CO₃ and K₂CO₃ with sp³-Hybridized Carbon Atoms. Crystal Growth & Design, 2023, 23 (9), 6589–6596. doi: 10.1021/acs.cgd.3c00507 IF 3.8

Метки: Eugeny V. Alexandrov, Q2, Samara State Technical University

19 августа 2023 г.
Comprehensive study of conductivity in the series of monoclinic oxymolybdates: Ln₂MoO₆ (Ln = Sm, Gd, Dy).

Yelizaveta A. Morkhova, Ekaterina I. Orlova, Artem A. Kabanov, Timofei A. Sorokin, Anastasia V. Egorova, Artem R. Gilev, Elena P. Kharitonova , Nikolay V. Lyskov, Valentina I. Voronkova, Natalia A. Kabanova Comprehensive study of conductivity in the series of monoclinic oxymolybdates: Ln₂MoO₆ (Ln = Sm, Gd, Dy). Solid State Ionics, 2023, 400, 116337. doi: 10.1016/j.ssi.2023.116337 IF 3.2

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q2, Samara Branch of LPI RAS, Samara State Technical University, Yelizaveta A. Morkhova

26 июля 2023 г.
Zinc(II) complexes of 3,5-bis(4-pyridyl)-1H-1,2,4-triazole: synthesis, the role of counter-anions in the formation of a type of crystal structure, and luminescence properties.

Alexey N. Gusev, Elena V. Braga, Ekaterina A. Zamnius, Igor A. Nauhatskiy, Maria A. Kryukova, Mikhail A. Kiskin, Eugeny V. Alexandrov, Andrey V. Sokolov, Wolfgang Linert Zinc(II) complexes of 3,5-bis(4-pyridyl)-1H-1,2,4-triazole: synthesis, the role of counter-anions in the formation of a type of crystal structure, and luminescence properties. Polyhedron, 2023, 243, 116573. doi: 10.1016/j.poly.2023.116573 IF 2.6

Метки: Eugeny V. Alexandrov, Q2, Samara Branch of LPI RAS, Samara State Technical University

6 июля 2023 г.
Impacts of Alkali Metals on the Structures and Properties of Fe(III) Heterometallic Cyclobutane-1,1-dicarboxylate Complexes.

Daniil O. Blinou, Ekaterina N. Zorina-Tikhonova, Julia K. Voronina, Maxim A. Shmelev, Anna K. Matiukhina, Pavel N. Vasilyev, Nikolay N. Efimov, Eugeny V. Alexandrov, Mikhail A. Kiskin, and Igor L. Eremenko Impacts of Alkali Metals on the Structures and Properties of Fe(III) Heterometallic Cyclobutane-1,1-dicarboxylate Complexes. Crystal Growth & Design, 2023, 23 (8), 5571–5582. doi: 10.1021/acs.cgd.3c00201 IF 3.8

Метки: Eugeny V. Alexandrov, Q2, Samara Branch of LPI RAS, Samara State Technical University

22 мая 2023 г.
Novel Topological Motifs and Superconductivity in Li-Cs System.

Hong-Mei Huang, Qiang Zhu, Vladislav A. Blatov, Artem R. Oganov, Xiaoting Wei, Peng Jiang, and Yan-Ling Li Novel Topological Motifs and Superconductivity in Li-Cs System. Nano Letters, 2023, 23 (11), 5012–5018. doi: 10.1021/acs.nanolett.3c00875 IF 12.262

Метки: Q1, Samara State Technical University, Vladislav A. Blatov

19 мая 2023 г.
Four metal-organic frameworks for the sensing of oxytetracycline/nitrofurazone and Fe³⁺ ions.

Xu-Peng Zhang, Lianshe Fu, Olga A. Blatova, Guang-Hua Cui Four metal-organic frameworks for the sensing of oxytetracycline/nitrofurazone and Fe³⁺ ions. Journal of Solid State Chemistry, 2023, 324, 124124. doi: 10.1016/j.jssc.2023.124124 IF 3.656

Метки: Olga A. Blatova, Q2, Samara State Technical University

8 мая 2023 г.
Activation Energy of Ion Diffusion in an Electrode Material: Theoretical Calculation and Experimental Estimation with LiCoVO₄ as an Example.

Kirill S. Rybakov, Arseni V. Ushakov, and Artem A. Kabanov Activation Energy of Ion Diffusion in an Electrode Material: Theoretical Calculation and Experimental Estimation with LiCoVO₄ as an Example. Processes, 2023, 11 (5), 1427. doi: 10.3390/pr11051427 IF 3.352

Метки: Artem A. Kabanov, Q2, Samara Branch of LPI RAS, Samara State Technical University

26 апреля 2023 г.
Unlocking New Topologies in Zr-Based Metal–Organic Frameworks by Combining Linker Flexibility and Building Block Disorder.

Charlotte Koschnick, Maxwell W. Terban, Ruggero Frison, Martin Etter, Felix A. Böhm, Davide M. Proserpio, Simon Krause, Robert E. Dinnebier, Stefano Canossa, and Bettina V. Lotsch Unlocking New Topologies in Zr-Based Metal–Organic Frameworks by Combining Linker Flexibility and Building Block Disorder. Journal of the American Chemical Society, 2023, 145 (18), 10051–10060. doi: 10.1021/jacs.2c13731 IF 16.383

Метки: Davide M. Proserpio, Q1

21 апреля 2023 г.
A topological approach to reconstructive solid-state transformations and its application for generation of new carbon allotropes.

A. A. Kabanov, E. O. Bukhteeva and V. A. Blatov A topological approach to reconstructive solid-state transformations and its application for generation of new carbon allotropes. Acta Crystallographica Section B, 2023, 79 (3), 198–206. doi: 10.1107/S205252062300255X IF 4.933

Метки: Artem A. Kabanov, Ekaterina О. Bukhteeva, Q1, Samara State Technical University, Vladislav A. Blatov

12 апреля 2023 г.
Local Atomic Configurations in Intermetallic Crystals: Beyond the First Coordination Shell.

Olga A. Blatova, Vladislav T. Osipov, Valeria E. Pavlova, Maria A. Solodovnikova, Ilya I. Trofimychev, Ekaterina M. Egorova, and Vladislav A. Blatov Local Atomic Configurations in Intermetallic Crystals: Beyond the First Coordination Shell. Inorganic Chemistry, 2023, 62 (16), 6214–6223. doi: 10.1021/acs.inorgchem.2c03607 IF 5.436

Метки: Ilya I. Trofimychev, Maria A. Solodovnikova, Olga A. Blatova, Q1, Samara State Technical University, Valeria E. Pavlova, Vladislav A. Blatov, Vladislav T. Osipov

1 марта 2023 г.
Three-periodic nets, tilings and surfaces. A short review and new results.

Olaf Delgado-Friedrichs, Michael O’Keeffe, Davide M. Proserpio and Michael M. J. Treacy Three-periodic nets, tilings and surfaces. A short review and new results. Acta Crystallographica Section A, 2023, 79 (2), 192–202. doi: 10.1107/S2053273323000414 IF 2.290

Метки: Davide M. Proserpio, Q1

24 февраля 2023 г.
Boron Substructures in Inorganic Borides: Network Topology and Free Space.

Inna V. Medrish and Vladislav A. Blatov Boron Substructures in Inorganic Borides: Network Topology and Free Space. Crystal Growth & Design, 2023, 23 (4), 2531–2539. doi: 10.1021/acs.cgd.2c01440 IF 4.010

Метки: Inna V. Medrish, Q1, Samara State Technical University, Vladislav A. Blatov

8 февраля 2023 г.
Pore topology analysis in porous molecular systems.

Verity Anipa, Andrew Tarzia, Kim E. Jelfs, Eugeny V. Alexandrov and Matthew A. Addicoat Pore topology analysis in porous molecular systems. Royal Society Open Science, 2023, 10 (2), 220813. doi: 10.1098/rsos.220813 IF 3.853

Метки: Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University

17 января 2023 г.
Elucidation of molecular crystals with one-, two- or three-dimensional geometrical models.

Vladislav A. Blatov Elucidation of molecular crystals with one-, two- or three-dimensional geometrical models. Acta Crystallographica Section B, 2023, 79 (1), 1–2. doi: 10.1107/S2052520623000203 IF 4.933

Метки: Q1, Samara State Technical University, Vladislav A. Blatov

16 января 2023 г.
Catenated covalent organic frameworks constructed from polyhedra.

Tianqiong Ma, Yi Zhou, Christian S. Diercks, Junpyo Kwon, Felipe Gándara, Hao Lyu, Nikita Hanikel, Pilar Pena-Sánchez, Yuzhong Liu, Nicolas J. Diercks, Robert O. Ritchie, Davide M. Proserpio, Osamu Terasaki & Omar M. Yaghi Catenated covalent organic frameworks constructed from polyhedra. Nature Synthesis, 2023, 2 (3), 286–295. doi: 10.1038/s44160-022-00224-z

Метки: Davide M. Proserpio

13 января 2023 г.
Prospective oxygen-ion conductors Ln_aX_bO_z: Geometry and energy calculations.

Natalya A. Kabanova, Yelizaveta A. Morkhova, Alexander V. Antonyuk, Eugeny I. Frolov Prospective oxygen-ion conductors Ln_aX_bO_z: Geometry and energy calculations. Solid State Ionics, 2023, 391, 116142. doi: 10.1016/j.ssi.2022.116142 IF 3.699

Метки: Alexander V. Antonyuk, Eugeny I. Frolov, Natalya A. Kabanova, Q1, Samara State Technical University, Yelizaveta A. Morkhova

152 page minimum spine. Editor: Matt Hotze, JEM: Esther
RTP: Diane Murphy

28 декабря 2022 г.
Magnocolumbites Mg_1–xMxNb₂O_6−δ (x = 0, 0.1, and 0.2; M = Li and Cu) as New Oxygen Ion Conductors: Theoretical Assessment and Experiment.

Yelizaveta A. Morkhova, Mariia S. Koroleva, Anastasia V. Egorova, Andrey A. Pimenov, Aleksei G. Krasnov, Boris A. Makeev, Vladislav A. Blatov, and Artem A. Kabanov Magnocolumbites Mg_1–xMxNb₂O_6−δ (x = 0, 0.1, and 0.2; M = Li and Cu) as New Oxygen Ion Conductors: Theoretical Assessment and Experiment. The Journal of Physical Chemistry C, 2023, 127 (1), 52–58. doi: 10.1021/acs.jpcc.2c06631 IF 4.177

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Vladislav A. Blatov, Yelizaveta A. Morkhova

9 декабря 2022 г.
Nishanbaevite, KAl₂O(AsO₄)(SO₄), a new As/S-ordered arsenate-sulfate mineral of fumarolic origin.

I. V. Pekov, N. V. Zubkova, V. O. Yapaskurt, D. I. Belakovskiy, S. N. Britvin, A. A. Agakhanov, A. G. Turchkova, E. G. Sidorov, A. V. Kutyrev, V. A. Blatov & D. Y. Pushcharovsky Nishanbaevite, KAl₂O(AsO₄)(SO₄), a new As/S-ordered arsenate-sulfate mineral of fumarolic origin. Mineralogy and Petrology, 2023, 117 (2), 247–257. doi: 10.1007/s00710-022-00803-0 IF 2.172

Метки: Q2, Samara State Technical University, Vladislav A. Blatov

4 ноября 2022 г.
Understanding Your Support System: The Design of a Stable Metal–Organic Framework/Polyazoamine Support for Biomass Conversion.

Vikram V. Karve, Nadezhda A. Nekrasova, Mehrdad Asgari, Olga Trukhina, Ilia V. Kochetygov, Hassan Abedini, Shuliang Yang, Eugeny V. Alexandrov, Jeremy S. Luterbacher, Wendy L. Queen Understanding Your Support System: The Design of a Stable Metal–Organic Framework/Polyazoamine Support for Biomass Conversion. Chemistry of Materials, 2022, 34 (22), 9854–9864. doi: 10.1021/acs.chemmater.2c01731 IF 10.508

Метки: Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University

1 октября 2022 г.
Janus structures of SMoSe and SVSe compositions with low enthalpy and unusual crystal chemistry.

P. Gavryushkin, N. Sagatov, E. Sukhanova, I. Medrish and Z. Popov Janus structures of SMoSe and SVSe compositions with low enthalpy and unusual crystal chemistry. Journal of Applied Crystallography, 2022, 55 (5), 1324–1335. doi: 10.1107/S1600576722008202 IF 4.475

Метки: Inna V. Medrish, Q1, Samara State Technical University

29 сентября 2022 г.
Three Zn(II) luminescent coordination polymers as sensors for the sensing of levofloxacin and benzaldehyde.

Xiang-Wen Wang, Yu-Qiao Su, Vladislav A. Blatov, Guang-Hua Cui Three Zn(II) luminescent coordination polymers as sensors for the sensing of levofloxacin and benzaldehyde. Journal of Molecular Structure, 2023, 1272, 134239. doi: 10.1016/j.molstruc.2022.134239 IF 3.841

Метки: Q2, Samara State Technical University, Vladislav A. Blatov

25 июля 2022 г.
Adsorption Properties and Gas Chromatographic Application of a Composite Surface-layer Sorbent with Terephthalic Acid-Based Metal-Organic Framework.

Lyudmila A. Onuchak, Kirill A. Kopytin, Yuliya G. Kuraeva, Mikhail Yu. Pariichuk, Yuliya V. Martina, Nikolai A. Vinogradov, Eugeny V. Alexandrov Adsorption Properties and Gas Chromatographic Application of a Composite Surface-layer Sorbent with Terephthalic Acid-Based Metal-Organic Framework. Journal of Chromatography A, 2022, 1679, 463373. doi: 10.1016/j.chroma.2022.463373 IF 4.601

Метки: Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University

4 июля 2022 г.
Design and synthesis of new luminescent coordination networks of sql topology showing the highest degrees of interpenetration.

Delia Blasi, Silvio Quici, Simonetta Orlandi, Pierluigi Mercandelli, Andrey V. Sokolov, Eugeny V. Alexandrov, Lucia Carlucci Design and synthesis of new luminescent coordination networks of sql topology showing the highest degrees of interpenetration. CrystEngComm, 2022, 24 (30), 5474–5486. doi: 10.1039/d2ce00884j IF 3.756

Метки: Andrey V. Sokolov, Eugeny V. Alexandrov, Q2, Samara Branch of LPI RAS, Samara State Technical University

24 июня 2022 г.
Topological representations of crystal structures: generation, analysis and implementation in the TopCryst system.

Alexander P. Shevchenko, Aleksandr A. Shabalin, Igor Yu. Karpukhin & Vladislav A. Blatov Topological representations of crystal structures: generation, analysis and implementation in the TopCryst system. Science and Technology of Advanced Materials: Methods, 2022, 2(1), 250–265. doi: 10.1080/27660400.2022.2088041 IF 3.585

Метки: Aleksandr A. Shabalin, Alexander P. Shevchenko, Branch of LPI RAS, Igor Yu. Karpukhin, Samara State Technical University, Samara University, Vladislav A. Blatov

23 июня 2022 г.
Chiral Motifs in Highly Interpenetrated Metal-Organic Frameworks Formed from Achiral Tetrahedral Ligands.

Qiang Wen, Maria Chiara di Gregorio, Linda Shimon, Iddo Pinkas, Naveen Malik, Anna Kossoy, Eugeny Alexandrov, Davide M. Proserpio, Michal Lahav, Milko Erik van der Boom Chiral Motifs in Highly Interpenetrated Metal-Organic Frameworks Formed from Achiral Tetrahedral Ligands. Chemistry – A European Journal, 2022, 28 (54), e202201108. doi: 10.1002/chem.202201108 IF 5.020

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara State Technical University

16 июня 2022 г.
Metal-organic frameworks in Russia: from the synthesis and structure to functional properties and materials.

M. A. Agafonov, E. V. Alexandrov, N. A. Artyukhova, G. E. Bekmukhamedov, V. A. Blatov, ... D. G. Yakhvarov Metal-organic frameworks in Russia: from the synthesis and structure to functional properties and materials. Journal of Structural Chemistry, 2022, 63 (5), 671–843. doi: 10.1134/S0022476622050018 IF 1.071

Метки: Eugeny V. Alexandrov, Q4, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov

10 июня 2022 г.
Generating triply periodic surfaces from crystal structures: the tiling approach and its application to zeolites.

M. I. Smolkov, O. A. Blatova, A. F. Krutov and V. A. Blatov Generating triply periodic surfaces from crystal structures: the tiling approach and its application to zeolites. Acta Crystallographica Section A, 2022, 78 (4), 327–336. doi: 10.1107/S2053273322004545 IF 2.290

Метки: Alexander F. Krutov, Michail I. Smolkov, Olga A. Blatova, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, Vladislav A. Blatov

7 июня 2022 г.
Hybrid DFT/Data-Driven Approach for Searching for New Quasicrystal Approximants in Sc-X (X = Rh, Pd, Ir, Pt) Systems.

Roman A. Eremin, Innokentiy S. Humonen, Pavel N. Zolotarev, Inna V. Medrish, Leonid E. Zhukov, and Semen A. Budennyy Hybrid DFT/Data-Driven Approach for Searching for New Quasicrystal Approximants in Sc-X (X = Rh, Pd, Ir, Pt) Systems. Crystal Growth & Design, 2022, 22 (7), 4570–4581. doi: 10.1021/acs.cgd.2c00463 IF 4.076

Метки: Inna V. Medrish, Pavel N. Zolotarev, Q1, Roman A. Eremin, Samara State Technical University

2 июня 2022 г.
Mechanism of Conductivity in the Rare Earth Layered Ln₂MoO₆ (Ln = La, Pr, and Nd) Oxymolybdates: Theoretical and Experimental Investigations.

Ekaterina I. Orlova, Yelizaveta A. Morkhova, Anastasia V. Egorova, Elena P. Kharitonova, Nikolay V. Lyskov, Valentina I. Voronkova, Artem A. Kabanov, Alexey A. Veligzhanin, and Natalia A. Kabanova Mechanism of Conductivity in the Rare Earth Layered Ln₂MoO₆ (Ln = La, Pr, and Nd) Oxymolybdates: Theoretical and Experimental Investigations. The Journal of Physical Chemistry C, 2022, 126 (23), 9623–9633. doi: 10.1021/acs.jpcc.2c01837 IF 4.126

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, Yelizaveta A. Morkhova

6 мая 2022 г.
Mining Knowledge from Crystal Structures: Oxidation States of Oxygen-Coordinated Metal Atoms in Ionic and Coordination Compounds.

Alexander P. Shevchenko, Michail I. Smolkov, Junjie Wang, and Vladislav A. Blatov Mining Knowledge from Crystal Structures: Oxidation States of Oxygen-Coordinated Metal Atoms in Ionic and Coordination Compounds. Journal of Chemical Information and Modeling, 2022, 62 (10), 2332–2340. doi: 10.1021/acs.jcim.2c00080 IF 4.956

Метки: Alexander P. Shevchenko, Michail I. Smolkov, Northwestern Polytechnical University, Q1, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov

1 апреля 2022 г.
Metal-organic frameworks as the basis for new-generation functional materials.

Gorbunova Yu. G., Fedin V. P. and Blatov V. A. Metal-organic frameworks as the basis for new-generation functional materials. Russian Chemical Reviews, 2022, 91(4), 5050. doi: 10.1070/RCR5050 IF 6.926

Метки: Q1, Samara State Technical University, Vladislav A. Blatov

1 апреля 2022 г.
Topological methods for analysis and design of coordination polymers.

Eugeny V. Alexandrov, Alexander P. Shevchenko, Nadezhda A. Nekrasova and Vladislav A. Blatov Topological methods for analysis and design of coordination polymers. Russian Chemical Reviews, 2022, 91(4), 5032. doi: 10.1070/RCR5032 IF 6.926

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Nadezhda A. Nekrasova, Q1, Samara State Technical University, Vladislav A. Blatov

21 марта 2022 г.
Topological transformations in metal–organic frameworks: a prospective design route?.

Eugeny V. Alexandrov, Yumin Yang, Lili Liang, Junjie Wang and Vladislav A. Blatov Topological transformations in metal–organic frameworks: a prospective design route? CrystEngComm, 2022, 24 (16), 2914–2924. doi: 10.1039/D2CE00264G IF 3.545

Метки: Eugeny V. Alexandrov, Northwestern Polytechnical University, Q1, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov

14 марта 2022 г.
Structural Features and the Li-Ion Diffusion Mechanism in Tantalum-Doped Li₇La₃Zr₂O₁₂ Solid Electrolytes.

Evgeniya Ilina, Efim Lyalin, Maxim Vlasov, Artem Kabanov, Kirill Okhotnikov, Elena Sherstobitova, and Mirijam Zobel Structural Features and the Li-Ion Diffusion Mechanism in Tantalum-Doped Li₇La₃Zr₂O₁₂ Solid Electrolytes. ACS Applied Energy Materials, 2022, 5 (3), 2959–2967. https://doi.org/10.1021/acsaem.1c03632 IF 6.024

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University

4 марта 2022 г.
Design and Synthesis of Coordination Polymers with Cu(II) and Heterocyclic N-Oxides.

Andrey V. Sokolov, Anna V. V. Vologzhanina, Tatyana V. Sudakova, Yulia V. Popova and Eugeny V. Alexandrov Design and Synthesis of Coordination Polymers with Cu(II) and Heterocyclic N-Oxides. CrystEngComm, 2022, 24 (13), 2505–2515. doi: 10.1039/D2CE00139J IF 3.545

Метки: Andrey V. Sokolov, Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Yulia V. Popova

15 февраля 2022 г.
Effect of transition metal cations on the local structure and lithium transport in disordered rock-salt oxides.

D. Semykina, Y. A. Morkhova, A. A. Kabanov, K. Mishchenko, A. Slobodyuk, M. Kirsanova, O. A. Podgornova, A. Shindrov, K. Okhotnikov and N. V. Kosova Effect of transition metal cations on the local structure and lithium transport in disordered rock-salt oxides. Physical Chemistry Chemical Physics, 2022, 24 (10), 5823–5832. doi: 10.1039/D1CP04993C IF 3.676

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University, Yelizaveta A. Morkhova

10 февраля 2022 г.
Analysis of the dependence of dimethylmalonate complexes structure on the nature of heterometals by the example of Co(II) и Cd(II) compounds with K and Ba atoms.

Natalia V. Gogoleva, Ekaterina N. Zorina-Tikhonova, Polina Y. Khapaeva, Maxim A. Shmelev, Mikhail A. Kiskin, Eugeny V. Alexandrov, Alexey A. Sidorov, Igor L. Eremenko Analysis of the dependence of dimethylmalonate complexes structure on the nature of heterometals by the example of Co(II) и Cd(II) compounds with K and Ba atoms. Journal of Molecular Structure, 2022, 1256. doi: 10.1016/j.molstruc.2022.132532 IF 3.196

Метки: Eugeny V. Alexandrov, Q2, Samara State Technical University

1 февраля 2022 г.
The role of local heteropolyhedral substitutions in the stoichiometry, topological characteristics and ion-migration paths in the eudialyte-related structures: a quantitative analysis.

S. M. Aksenov, N. A. Kabanova, N. V. Chukanov, T. L. Panikorovskii, V. A. Blatov and S. V. Krivovichev The role of local heteropolyhedral substitutions in the stoichiometry, topological characteristics and ion-migration paths in the eudialyte-related structures: a quantitative analysis. Acta Crystallographica Section B, 2022, 78 (1), 80–90. doi: 10.1107/S2052520621010015 IF 4.711

Метки: Natalya A. Kabanova, Q1, Samara State Technical University, Vladislav A. Blatov

25 января 2022 г.
Computational design of materials for metal-ion batteries.

Artem A. Kabanov, Yelizaveta A. Morkhova, Iliya A. Bezuglov, Vladislav A. Blatov Computational design of materials for metal-ion batteries. In Comprehensive Inorganic Chemistry III. Elsevier, 2023, 404–429. doi: 10.1016/B978-0-12-823144-9.00062-5

Метки: Artem A. Kabanov, Samara Branch of LPI RAS, Samara State Technical University, Vladislav A. Blatov, Yelizaveta A. Morkhova

25 января 2022 г.
Morphotropism in fumarolic mineral-related anhydrous sulfates: novel representatives in A⁺₂M²⁺(SO₄)₂ and A⁺₂M²⁺₂(SO₄)₃ series.

O. I. Siidra, D. Nekrasova, O. Blatova, M. Colmont, O. Mentré and D. Charkin Morphotropism in fumarolic mineral-related anhydrous sulfates: novel representatives in A⁺₂M²⁺(SO₄)₂ and A⁺₂M²⁺₂(SO₄)₃ series. Acta Crystallographica Section B, 2022, 78 (2), 153–161. doi.: 10.1107/S2052520622000919 IF 4.711

Метки: Olga A. Blatova, Q1, Samara State Technical University

19 января 2022 г.
Discovery of Electrides in Electron-Rich Non-Electride Materials via Energy Modification of Interstitial Electrons.

Kun Li, Vladislav A. Blatov, Junjie Wang Discovery of Electrides in Electron-Rich Non-Electride Materials via Energy Modification of Interstitial Electrons. Advanced Functional Materials, 2022, 32 (17), 2112198. doi: 10.1002/adfm.202112198 IF 18.808

Метки: Northwestern Polytechnical University, Q1, Samara State Technical University, Vladislav A. Blatov

29 декабря 2021 г.
Polymorphism and topological features of compounds with the general formula A⁺_1-xB²⁺_x{M²⁺_xM³⁺_1-x [BP₂O₈(OH)]} (where x = 0, 1): Synthesis and structure refinement of Rb{V[BP₂O₈(OH)]}, analysis of the ion-migration paths, and comparative crystal chemistry of vanadium borophosphates.

Sergey M. Aksenov, Julia S. Mironova, Natalia A. Yamnova, Anatoly S. Volkov, Olga V. Dimitrova, Olga A. Gurbanova, Dina V. Deyneko, Vladislav A. Blatov, Sergey V. Krivovichev Polymorphism and topological features of compounds with the general formula A⁺_1-xB²⁺_x{M²⁺_xM³⁺_1-x [BP₂O₈(OH)]} (where x = 0, 1): Synthesis and structure refinement of Rb{V[BP₂O₈(OH)]}, analysis of the ion-migration paths, and comparative crystal chemistry of vanadium borophosphates. Journal of Solid State Chemistry, 2021. doi: 10.1016/j.jssc.2021.122831 IF 3.498

Метки: Q2, Samara State Technical University, Vladislav A. Blatov

7 декабря 2021 г.
Metallization-Prompted Robust Porphyrin-Based Hydrogen-Bonded Organic Frameworks for Photocatalytic CO2 Reduction.

Qi Yin,Eugeny V. Alexandrov, Duan-Hui Si, Qian-Qian Huang, Zhi-Bin Fang, Yuan Zhang, An-An Zhang, Wei-Kang Qin, Yu-Lin Li, Tian-Fu Liu, Davide M. Proserpio Metallization-Prompted Robust Porphyrin-Based Hydrogen-Bonded Organic Frameworks for Photocatalytic CO2 Reduction. Angewandte Chemie, 2022, 61 (6), e202115854. doi:10.1002/anie.202115854 IF 15.336

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara State Technical University

2 декабря 2021 г.
The nyerereite crystal structure: a possible messenger from the deep Earth.

Azzurra Zucchin, Pavel N. Gavryushkin, Alexander V. Golovin, Nadezhda B. Bolotina, Paola Stabile, Michael Robert Carroll, Paola Comodi, Francesco Frondini, Daniele Morgavi, Diego Perugini, Fabio Arzilli, Marco Cherin, Emmanuel Kazimoto, Konstantin Kokh, Artem Kuznetsov, and Inna V. Medrish The nyerereite crystal structure: a possible messenger from the deep Earth. American Mineralogist, 2021, 2022, 107 (11), 2054–2064. doi: 10.2138/am-2022-8106 IF 3.003

Метки: Inna V. Medrish, Q1, Samara State Technical University

17 ноября 2021 г.
Two robust Zn(II)-organic frameworks as dual-functional fluorescent probes for efficient sensing of enrofloxacin and MnO4⁻ anions.

Yu-Qiao Su, Ruo-Tong Wang, Olga A. Blatova, Yong-Sheng Shi and Guang-Hua Cui Two robust Zn(II)-organic frameworks as dual-functional fluorescent probes for efficient sensing of enrofloxacin and MnO4⁻ anions. CrystEngComm, 2022, 24 (1), 182–191. doi: 10.1039/D1CE01447A IF 3.545

Метки: Olga A. Blatova, Q1, Samara State Technical University

30 октября 2021 г.
Oxygen ionic transport in LaInO₃ and LaIn_0.5Zn_0.5O_2.75 perovskites: Theory and experiment.

A. V. Egorova, Ye. A. Morkhova, A. A. Kabanov, K. G. Belova, I. E. Animitsa, V. A. Blatov, A. A. Pimenov, D. V. Korona Oxygen ionic transport in LaInO₃ and LaIn_0.5Zn_0.5O_2.75 perovskites: Theory and experiment. Solid State Ionics, 2021, 115790. doi: 10.1016/j.ssi.2021.115790 IF 3.785

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, Vladislav A. Blatov, Yelizaveta A. Morkhova

27 октября 2021 г.
Visualization and Quantification of Geometric Diversity in Metal–Organic Frameworks.

Thomas C. Nicholas, Eugeny V. Alexandrov, Vladislav A. Blatov, Alexander P. Shevchenko, Davide M. Proserpio, Andrew L. Goodwin, and Volker L. Deringer Visualization and Quantification of Geometric Diversity in Metal–Organic Frameworks. Chemistry of Materials, 2021, 33 (21), 8289–8300. doi: 10.1021/acs.chemmater.1c02439 IF 9.811

Метки: Alexander P. Shevchenko, Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, Vladislav A. Blatov

21 октября 2021 г.
Design of MOFs with Absolute Structures: A Case Study.

Haoze Wang, Xiaokun Pei, Davide M. Proserpio, Omar M. Yaghi Design of MOFs with Absolute Structures: A Case Study. Israel Journal of Chemistry, 61 (11-12), 774–781. doi: 10.1002/ijch.202100102 IF 3.333

Метки: Davide M. Proserpio, Q1, Samara State Technical University

2 сентября 2021 г.
An Amino-Decorated Self-Catenated Metal–Organic Framework for Efficient Capture and Conversion of CO₂.

Ting Zhou, Shuang Liu, Eugeny V. Alexandrov, Huadong Guo, Pan Gao, Shengyong Mi, Qijin Su, Xianmin Guo, and Ting Hu An Amino-Decorated Self-Catenated Metal–Organic Framework for Efficient Capture and Conversion of CO₂. Crystal Growth & Design, 2021, 21 (10), 5724–5730. doi: 10.1021/acs.cgd.1c00564 IF 4.076

Метки: Eugeny V. Alexandrov, Q1, Samara University

6 августа 2021 г.
Computational Search for Novel Zn-Ion Conductors – A Crystallochemical, Bond Valence, and Density Functional Study.

Yelizaveta A. Morkhova, Manuel Rothenberger, Tilmann Leisegang, Stefan Adams, Vladislav A. Blatov, and Artem A. Kabanov Computational Search for Novel Zn-Ion Conductors – A Crystallochemical, Bond Valence, and Density Functional Study. The Journal of Physical Chemistry C, 2021, 125 (32), 17590–17599. doi: 10.1021/acs.jpcc.1c02984 IF 4.126

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, Vladislav A. Blatov, Yelizaveta A. Morkhova

20 июля 2021 г.
2.21 — Topology: ToposPro.

Vladislav A. Blatov, Eugeny V. Alexandrov, Alexander P. Shevchenko, 2.21 - Topology: ToposPro. In Comprehensive Coordination Chemistry III (Third Edition). Elsevier, 2021, 389–412. doi: 10.1016/B978-0-12-409547-2.14576-7

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Samara State Technical University, Samara University, Vladislav A. Blatov

15 июля 2021 г.
Designing All Graphdiyne Materials as Graphene Derivatives: Topologically Driven Modulation of Electronic Properties.

Patrick Serafini, Alberto Milani, Davide M. Proserpio, and Carlo S. Casari Designing All Graphdiyne Materials as Graphene Derivatives: Topologically Driven Modulation of Electronic Properties. The Journal of Physical Chemistry C, 2021, 125 (33), 18456–18466. doi: 10.1021/acs.jpcc.1c04238 IF 4.126

Метки: Davide M. Proserpio, Q1, Samara State Technical University

12 июля 2021 г.
Relationships between Changes in Guest Ion Properties and in the Host Framework Topology in Ionic Coordination Polymers.

Pavel N. Zolotarev Relationships between Changes in Guest Ion Properties and in the Host Framework Topology in Ionic Coordination Polymers. Crystal Growth & Design, 2021, 21 (9), 4959–4970. doi: 10.1021/acs.cgd.1c00405 IF 4.076

Метки: Pavel N. Zolotarev, Q1, Samara State Technical University

22 июня 2021 г.
The Different Story of π Bonds.

Marco Cappelletti, Mirko Leccese, Matteo Cococcioni, Davide M. Proserpio and Rocco Martinazzo The Different Story of π Bonds. Molecules, 2021, 26 (13), 3805. doi: 10.3390/molecules26133805 IF 3.589

Метки: Davide M. Proserpio, Q1, Samara State Technical University

17 мая 2021 г.
B₅N₃ and B₇N₅ Monolayers with High Carrier Mobility and Excellent Optical Performance.

Jingcheng Qi, Shiyao Wang, Junjie Wang, Naoto Umezawa, Vladislav A. Blatov, and Hideo Hosono B₅N₃ and B₇N₅ Monolayers with High Carrier Mobility and Excellent Optical Performance. The Journal of Physical Chemistry Letters, 2021, 12 (20), 4823–4832. doi: 10.1021/acs.jpclett.1c00913 IF 6.71

Метки: Northwestern Polytechnical University, Q1, Samara State Technical University, Vladislav A. Blatov

19 апреля 2021 г.
Coordination Properties of Hydroxyisophthalic Acids: Topological Correlations, Synthesis, Structural Analysis, and Properties of New Complexes.

Andrey V. Sokolov, Anna V. Vologzhanina, Ekaterina D. Barabanova, Sergey Yu. Stefanovich, Pavel V. Dorovatovskii, Ilya V. Taydakov, Eugeny V. Alexandrov Coordination Properties of Hydroxyisophthalic Acids: Topological Correlations, Synthesis, Structural Analysis, and Properties of New Complexes. Chemistry - A European Journal, 2021, 27 (35), 9180. doi: 10.1002/chem.202100733 IF 4.857

Метки: Andrey V. Sokolov, Ekaterina D. Barabanova, Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University

15 апреля 2021 г.
Crystal and electronic structure engineering of tin monoxide by external pressure.

Kun Li, Junjie Wang, Vladislav A. Blatov, Yutong Gong, Naoto Umezawa, Tomofumi Tada, Hideo Hosono & Artem R. Oganov Crystal and electronic structure engineering of tin monoxide by external pressure. Journal of Advanced Ceramics, 2021, 10 (3), 565–577. doi: 10.1007/s40145-021-0458-1 IF 2.889

Метки: Northwestern Polytechnical University, Q2, Samara State Technical University, Samara University, Vladislav A. Blatov

20 марта 2021 г.
Discovery of intrinsic two-dimensional antiferromagnets from transition-metal borides.

Shiyao Wang, Nanxi Miao, Kehe Su, Vladislav A. Blatov and Junjie Wang Discovery of intrinsic two-dimensional antiferromagnets from transition-metal borides. Nanoscale, 2021, 13 (17), 8254–8263. doi: 10.1039/D1NR01103K IF 6.895

Метки: Q1, Samara State Technical University, Vladislav A. Blatov

7 марта 2021 г.
High-Throughput Electron Diffraction Reveals a Hidden Novel Metal–Organic Framework for Electrocatalysis.

Meng Ge, Yanzhi Wang, Francesco Carraro, Weibin Liang, Morteza Roostaeinia, Samira Siahrostami, Davide M. Proserpio, Christian Doonan, Paolo Falcaro, Haoquan Zheng, Xiaodong Zou, Zhehao Huang High-Throughput Electron Diffraction Reveals a Hidden Novel Metal–Organic Framework for Electrocatalysis. Angewandte Chemie International Edition, 60 (20), 11391–11397. doi: 10.1002/anie.202016882 IF 12.959

Метки: Davide M. Proserpio, Q1, Samara State Technical University

26 февраля 2021 г.
Topological Features of the Alluaudite-Type Framework and Its Derivatives: Synthesis and Crystal Structure of NaMnNi₂(H_2/3PO₄)₃..

Sergey M. Aksenov, Natalia A. Yamnova, Natalia A. Kabanova, Anatoly S. Volkov, Olga A. Gurbanova, Dina V. Deyneko, Olga V. Dimitrova and Sergey V. Krivovichev Topological Features of the Alluaudite-Type Framework and Its Derivatives: Synthesis and Crystal Structure of NaMnNi₂(H_2/3PO₄)₃. Crystals, 2021, 11(3), 237. doi: 10.3390/cryst11030237 IF 2.404

Метки: Natalya A. Kabanova, Q2, Samara State Technical University

27 января 2021 г.
High-throughput systematic topological generation of low-energy carbon allotropes.

Vladislav A. Blatov, Changhao Yang, Dingyi Tang, Qingfeng Zeng, Andrey A. Golov & Artem A. Kabanov High-throughput systematic topological generation of low-energy carbon allotropes. npj Computational Materials, 2021, 7, 15. doi:10.1038/s41524-021-00491-y IF 11.282

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

5 января 2021 г.
Simplify to understand: how to elucidate crystal structures?.

Alexander P. Shevchenko & Vladislav A. Blatov Simplify to understand: how to elucidate crystal structures? Structural Chemistry, 2021, 32 (2), 507–519. doi:10.1007/s11224-020-01724-4 IF 2.081

Метки: Alexander P. Shevchenko, Q3, Samara Branch of LPI RAS, Samara State Technical University, ToposPro, Vladislav A. Blatov

21 декабря 2020 г.
Facile synthesis and structure elucidation of metal-organic frameworks with {ZnCa} and {Zn₂Ca} metal cores.

Irina K.Rubtsova, Stanislav N.Melnikov, Maxim A.Shmelev, Stanislav A.Nikolaevskii, Ilya A.Yakushev, Julia K.Voronina, Ekaterina D.Barabanova, Mikhail A.Kiskin, Alexey A.Sidorov, Igor L.Eremenko Facile synthesis and structure elucidation of metal-organic frameworks with {ZnCa} and {Zn₂Ca} metal cores. Mendeleev Communications, 2020, 30 (6), 722–724. doi: 10.1016/j.mencom.2020.11.011 IF 1.694

Метки: Ekaterina D. Barabanova, Q2, Samara State Technical University

10 декабря 2020 г.
Metastable structures of CaCO₃ and their role in transformation of calcite to aragonite and postaragonite.

Pavel N. Gavryushkin, Anatoly B. Belonoshko, Nursultan Sagatov, Dinara Sagatova, Elena Zhitova, Maria G. Krzhizhanovskaya, Aleksander Rečnik, Eugeny V. Alexandrov, Inna V. Medrish, Zakhar I. Popov, and Konstantin D. Litasov Metastable structures of CaCO₃ and their role in transformation of calcite to aragonite and postaragonite. Crystal Growth and Design, 2021, 21, 1, 65–74. doi: 10.1021/acs.cgd.0c00589 IF 4.089

Метки: Eugeny V. Alexandrov, Inna V. Medrish, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University

1 декабря 2020 г.
Phase Relations of Iron Carbides Fe₂C, Fe₃C, and Fe₇C₃ at the Earth’s Core Pressures and Temperatures.

N.E. Sagatov, P.N. Gavryushkin, I.V. Medrish, T.M. Inerbaev, K.D. Litasov Phase Relations of Iron Carbides Fe₂C, Fe₃C, and Fe₇C₃ at the Earth’s Core Pressures and Temperatures. Russian Geology and Geophysics, 2020, 61 (12), 1345–1353. doI: 10.15372/RGG2019146 IF 1.150

Метки: Inna V. Medrish, Q2, Samara State Technical University, Samara University

18 ноября 2020 г.
CrystalGrower: A Generic Computer Program for Monte Carlo Modelling of Crystal Growth.

Michael William Anderson, Adam R Hill, James T Gebbie, Pablo Cubillas, Mollie Trueman, Nathan de Bruyn, Zulaikha al Harthi, Rachel Pooley, Martin Attfield, Vladislav A. Blatov, Davide M Proserpio, Julian Gale, Duncan Akporiaye and Bjørnar Arstad CrystalGrower: A Generic Computer Program for Monte Carlo Modelling of Crystal Growth. Chemical Science, 2021, 12 (3), 1126–1146. doi: 10.1039/D0SC05017B IF 9.346

Метки: Davide M. Proserpio, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

9 ноября 2020 г.
The Na_2−nH_n[Zr(Si₂O₇)]·mH₂O Minerals and Related Compounds (n = 0–0.5; m = 0.1): Structure Refinement, Framework Topology, and Possible Na⁺-Ion Migration Paths.

Natalya A. Kabanova, Taras L. Panikorovskii, Natalya S. Vlasenko, Victor N. Yakovenchuk, Sergey M. Aksenov, Vladimir N. Bocharov and Sergey V. Krivovichev The Na_2−nH_n[Zr(Si₂O₇)]·mH₂O Minerals and Related Compounds (n = 0–0.5; m = 0.1): Structure Refinement, Framework Topology, and Possible Na⁺-Ion Migration Paths. Crystals, 2020, 10 (11), 1016. doi:10.3390/cryst10111016 IF 2.404

Метки: Natalya A. Kabanova, Q2, Samara State Technical University

2 ноября 2020 г.
Polynuclear architectures with cadmium and lithium ions based on the {Li₂Cd₂(O₂CCMe₃)₆} fragment.

N.V.Gogoleva, G.N.Kuznetsova, M.A.Shmelev, K.A.Lyssenko, D.B.Kayumova, I.P.Malkerova, A.S.Alikhanyan, A.A.Starikova, E.D.Barabanova, M.A.Kiskin, A.A.Sidorov, I.L.Eremenko Polynuclear architectures with cadmium and lithium ions based on the {Li₂Cd₂(O₂CCMe₃)₆} fragment. Journal of Solid State Chemistry, 2020, 294, 121842. doi: 10.1016/j.jssc.2020.121842 IF 2.726

Метки: Ekaterina D. Barabanova, Q2, Samara State Technical University

29 октября 2020 г.
Size-Selective Urea-Containing Metal–Organic Frameworks as Receptors for Anions.

Leili Esrafili, Ali Morsali, Mao-Lin Hu, Alireza Azhdari Tehrani, Lucia Carlucci, Pierluigi Mercandelli, and Davide M. Proserpio Size-Selective Urea-Containing Metal–Organic Frameworks as Receptors for Anions. Inorganic Chemistry, 2020, 59 (22), 16421–16429. doi: 10.1021/acs.inorgchem.0c02215 IF 4.825

Метки: Davide M. Proserpio, Q1, Samara State Technical University

21 октября 2020 г.
Sorption of multivalent cations on titanosilicate obtained from natural raw materials. The mechanism and thermodynamics of sorption.

Igor А. Perovskiy, Nataliya Y. Yanicheva, Valery V. Stalyugin, Taras L. Panikorovskii, Andrey A. Golov Sorption of multivalent cations on titanosilicate obtained from natural raw materials. The mechanism and thermodynamics of sorption. Microporous and Mesoporous Materials, 2021, 311, 110716. doi: 10.1016/j.micromeso.2020.110716 IF 4.551

Метки: Q1, Samara State Technical University, Samara University

17 сентября 2020 г.
On the Influence of Solvent Properties on the Structural Characteristics of Molecular Crystal Polymorphs.

Pavel N. Zolotarev and Nadezhda A. Nekrasova On the Influence of Solvent Properties on the Structural Characteristics of Molecular Crystal Polymorphs. Crystal Growth & Design, 2020, 20 (11), 7152–7162. doi: 10.1021/acs.cgd.0c00753 IF 4.089

Метки: Nadezhda A. Nekrasova, Pavel N. Zolotarev, Q1, Samara State Technical University

6 сентября 2020 г.
Supramolecular architectures of Mn(NCS)2 complexes with N‘-(1-(pyridin-4-yl)ethylidene)picolinohydrazide and N‘-(phenyl(pyridin-4-yl)methylene)isonicotinohydrazide.

Ghodrat Mahmoudi, Maciej Kubicki, Duane Choquesillo-Lazarte, Barbara Miroslaw, Eugeny V. Alexandrov, Pavel N. Zolotarev, Antonio Frontera, Damir A. Safin Supramolecular architectures of Mn(NCS)2 complexes with N'-(1-(pyridin-4-yl)ethylidene)picolinohydrazide and N'-(phenyl(pyridin-4-yl)methylene)isonicotinohydrazide. Polyhedron, 2020, 190, 114776. doi: 10.1016/j.poly.2020.114776 IF 2.343

Метки: Eugeny V. Alexandrov, Pavel N. Zolotarev, Q2, Samara Branch of LPI RAS, Samara State Technical University

6 сентября 2020 г.
From Simple to Complex: Design of Inorganic Crystal Structures with a Topologically Extended Zintl–Klemm Concept.

Inna V. Medrish, Roman A. Eremin, and Vladislav A. Blatov From Simple to Complex: Design of Inorganic Crystal Structures with a Topologically Extended Zintl–Klemm Concept. Journal of Physical Chemistry Letters, 2020, 11 (19), 8114–8120. doi:10.1021/acs.jpclett.0c02468 IF 6.71

Метки: Inna V. Medrish, Q1, Samara State Technical University, ToposPro, Vladislav A. Blatov

18 августа 2020 г.
Theoretical and experimental study of reversible intercalation of Li ions in the Jarosite NaFe₃(SO₄)₂(OH)₆ structure.

Nina V. Kosova, Alexander A. Shindrov, Artem A. Kabanov Theoretical and experimental study of reversible intercalation of Li ions in the Jarosite NaFe₃(SO₄)₂(OH)₆ structure. Electrochimica Acta, 2020, 359, 136950. doi:10.1016/j.electacta.2020.136950 IF 6.215

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University

21 июля 2020 г.
Combined DFT and geometrical–topological analysis of Li-ion conductivity in complex hydrides.

Valerio Gulino, Anna Wolczyk, Andrey A. Golov, Roman A. Eremin, Mauro Palumbo, Carlo Nervi, Vladislav A. Blatov, Davide M. Proserpio and Marcello Baricco Combined DFT and geometrical–topological analysis of Li-ion conductivity in complex hydrides. Inorganic Chemistry Frontiers, 2020, 7 (17), 3115–3125. doi: 10.1039/D0QI00577K IF 5.934

Метки: Davide M. Proserpio, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

16 июля 2020 г.
Topology versus porosity: what can reticular chemistry tell us about free space in metal-organic frameworks?.

Alexander P. Shevchenko, Eugeny V. Alexandrov, Andrey A. Golov, Olga A. Blatova, Alexandra S. Duyunova and Vladislav A. Blatov Topology versus porosity: what can reticular chemistry tell us about free space in metal-organic frameworks? Chemical Communications, 2020, 56 (67), 9616-9619. doi: 10.1039/D0CC04004E IF 6.164

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Olga A. Blatova, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

26 июня 2020 г.
Pyroelectrically-driven chemical reactions described by a novel thermodynamic cycle.

Mateo U. de Vivanco, Matthias Zschornak, Hartmut Stöcker, Sven Jachalke, Erik Mehner, Tilmann Leisegang and Dirk C. Meyer Pyroelectrically-driven chemical reactions described by a novel thermodynamic cycle. Physical Chemistry Chemical Physics, 2020, 22 (32), 17781–17790. doi: 10.1039/D0CP01288B IF 3.567

Метки: Q1, Samara State Technical University

25 июня 2020 г.
Crystal structure and migration paths of alkaline ions in NaVPO₄F.

D. Semykina, I. Yakovlev, O. B. Lapina, A. A. Kabanov and N. V. Kosova Crystal structure and migration paths of alkaline ions in NaVPO₄F. Physical Chemistry Chemical Physics, 2020, 22 (28), 15876–15884. doi: 10.1039/D0CP02204G IF 3.567

Метки: Artem A. Kabanov, Q1, Samara Branch of LPI RAS, Samara State Technical University

20 июня 2020 г.
Two d¹⁰ metal coordination polymers as dual functional luminescent probes for sensing of Fe³⁺ ions and acetylacetone with high selectivity and sensitivity.

Miao-Miao Fu, Yun-Hua Qu, Vladislav A. Blatov, Yue-Hua Li, Guang-Hua Cui Two d¹⁰ metal coordination polymers as dual functional luminescent probes for sensing of Fe³⁺ ions and acetylacetone with high selectivity and sensitivity. Journal of Solid State Chemistry, 2020, 289, 121460. doi: 10.1016/j.jssc.2020.121460 IF 2.291

Метки: Q2, Samara University, Vladislav A. Blatov

12 июня 2020 г.
Exploring the performance of pristine and defective silicene and silicene-like XSi₃ (X= Al, B, C, N, P) sheets as supercapacitor electrodes: A density functional theory calculation of quantum capacitance.

Mohammad Jafar Momeni, Morteza Mousavi-Khoshdel, Tilmann Leisegang Exploring the performance of pristine and defective silicene and silicene-like XSi₃ (X= Al, B, C, N, P) sheets as supercapacitor electrodes: A density functional theory calculation of quantum capacitance. Physica E: Low-dimensional Systems and Nanostructures, 2020, 124, 114290. doi: 10.1016/j.physe.2020.114290 IF 3.176

Метки: Q2, Samara State Technical University

4 июня 2020 г.
Hierarchically Structured Allotropes of Phosphorus from Data‐Driven Exploration.

Volker L. Deringer, Chris J. Pickard, and Davide M. Proserpio Hierarchically Structured Allotropes of Phosphorus from Data‐Driven Exploration. Angewandte Chemie International Edition, 2020, 59 (37), 15880–15885. doi: 10.1002/anie.202005031 IF 12.959

Метки: Davide M. Proserpio, Q1, Samara State Technical University

15 мая 2020 г.
Structure variations within RSi₂ and R₂Si₃ silicides. Part II. Structure driving factors.

M. Nentwich, M. Zschornak, M. Sonntag, R. Gumeniuk, S. Gemming, T. Leisegang and D. C. Meyer Structure variations within RSi₂ and R₂Si₃ silicides. Part II. Structure driving factors . Acta Crystallographica Section B, 2020, 76 (3), 378–410. doi: 10.1107/S2052520620003893 IF 6.732

Метки: Q1, Samara State Technical University

8 мая 2020 г.
Nanoporous materials with predicted zeolite topologies.

Vladislav A. Blatov, Olga A. Blatova, Frits Daeyaert and Michael W. Deem Nanoporous materials with predicted zeolite topologies. RSC Advances, 2020, 10, 17760–17767. doi: 10.1039/D0RA01888K IF 3.168

Метки: Olga A. Blatova, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

1 мая 2020 г.
Isotopy classes for 3-periodic net embeddings.

S. C. Power, I. A. Baburin and D. M. Proserpio Isotopy classes for 3-periodic net embeddings. Acta Crystallographica Section A, 2020, 76 (3), 275–301. doi: 10.1107/S2053273320000625 IF 4.647

Метки: Davide M. Proserpio, Q1, Samara State Technical University

28 апреля 2020 г.
A New Group of Edge-transitive 3-Periodic Nets and Their Derived Nets for Reticular Chemistry.

Mian Li, Michael O’Keeffe, Davide M. Proserpio, and Hai-Feng Zhang A New Group of Edge-transitive 3-Periodic Nets and Their Derived Nets for Reticular Chemistry. Crystal Growth & Design, 2020, 20 (6), 4062–4068. doi: 10.1021/acs.cgd.0c00275 IF 4.089

Метки: Davide M. Proserpio, Q1, Samara State Technical University

23 апреля 2020 г.
Solid-State 1D → 3D Transformation of Polynitrile-Based Coordination Polymers by Dehydration Reaction.

Artem O. Dmitrienko, Michail I. Buzin, Zouaoui Setifi, Fatima Setifi, Eugeny V. Alexandrov, Eugenia D. Voronova and Anna V. V. Vologzhanina Solid-State 1D → 3D Transformation of Polynitrile-Based Coordination Polymers by Dehydration Reaction. Dalton Transactions, 2020, 49 (21), 7084–7092. doi: 10.1039/D0DT00917B IF 4.052

Метки: Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University

22 апреля 2020 г.
Monolayer self‐organization of cyclodextrins on carbon surface.

Egor S. Bykov, Kirill A. Kopytin, Lyudmila A. Onuchak, Vladislav A. Blatov Monolayer self‐organization of cyclodextrins on carbon surface. Journal of the Chinese Chemical Society, 2020, 67 (10), 1778-1782. doi: 10.1002/jccs.201900544 IF 1.188

Метки: Northwestern Polytechnical University, Q3, Samara University, Vladislav A. Blatov

18 апреля 2020 г.
Phase Diagrams of Iron Hydrides at Pressures of 100–400 GPa and Temperatures of 0–5000 K.

D.N. Sagatova, P.N. Gavryushkin, N.E. Sagatov, I. V. Medrish, K.D. Litasov Phase Diagrams of Iron Hydrides at Pressures of 100–400 GPa and Temperatures of 0–5000 K. JETP Letters, 2020, 111, 145–150. doi: 10.1134/S0021364020030108 IF 1.412

Метки: Inna V. Medrish, Q2, Samara State Technical University, Samara University

14 апреля 2020 г.
X-ray diffraction using focused-ion-beam-prepared single crystals.

Tina Weigel, Claudia Funke, Matthias Zschornak, Thomas Behm, Hartmut Stöcker, Tilmann Leisegang and Dirk C. Meyer X-ray diffraction using focused-ion-beam-prepared single crystals. Journal of Applied Crystallography, 2020, 2020, 53 (3), 614–622. doi: 10.1107/S1600576720003143 IF 3.527

Метки: Q1, Samara State Technical University

2 апреля 2020 г.
The CSD and knowledge databases: from answers to questions.

Alexander P. Shevchenko, Roman A. Eremin and Vladislav A. Blatov The CSD and knowledge databases: from answers to questions. CrystEngComm, 2020, 22 (43), 7298–7307. doi: 10.1039/D0CE00265H IF 3.382

Метки: Alexander P. Shevchenko, Q1, Samara Branch of LPI RAS, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

1 апреля 2020 г.
Structure variations within RSi₂ and R₂TSi₃ silicides. Part I. Structure overview.

M. Nentwich, M. Zschornak, M. Sonntag, R. Gumeniuk, S. Gemming, T. Leisegang and D. C. Meyer Structure variations within RSi₂ and R₂TSi₃ silicides. Part I. Structure overview. Acta Crystallographica Section B, 2020, 76 (2), 177–200. doi: 10.1107/S2052520620001043 IF 6.732

Метки: Q1, Samara University

26 марта 2020 г.
Record Complexity in the Polycatenation of Three Porous Hydrogen-Bonded Organic Frameworks with Stepwise Adsorption Behaviors.

Yu-Lin Li, Eugeny V. Alexandrov, Qi Yin, Lan Li, Zhi-Bin Fang, Wenbing Yuan, Davide M. Proserpio, Tian-Fu Liu Record Complexity in the Polycatenation of Three Porous Hydrogen-Bonded Organic Frameworks with Stepwise Adsorption Behaviors. Journal of the American Chemical Society, 2020, 142 (15), 7218–7224. doi: 10.1021/jacs.0c02406 IF 14.695

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara Branch of LPI RAS, Samara State Technical University

16 января 2020 г.
A Porous Covalent Organic Framework with Voided Square Grid Topology for Atmospheric Water Harvesting.

Ha L. Nguyen, Nikita Hanikel, Steven J. Lyle, Chenhui Zhu, Davide M. Proserpio, Omar M. Yaghi A Porous Covalent Organic Framework with Voided Square Grid Topology for Atmospheric Water Harvesting. Journal of the American Chemical Society, 2020, 142 (5), 2218–2221. doi: 10.1021/jacs.9b13094 IF 14.695

Метки: Davide M. Proserpio, Q1, Samara State Technical University

15 января 2020 г.
A new quasicrystal approximant in the Sc–Pd system: from topological data mining to the bench.

Pavlo Solokha, Roman A. Eremin, Tilmann Leisegang, Davide M. Proserpio, Tatiana Akhmetshina, Albina Gurskaya, Adriana Saccone, Serena De Negri A new quasicrystal approximant in the Sc–Pd system: from topological data mining to the bench. Chemistry of Materials, 2020, 32 (3), 1064–1079. doi: 10.1021/acs.chemmater.9b03767 IF 10.159

Метки: Davide M. Proserpio, Q1, Samara State Technical University, Samara University

9 января 2020 г.
Crystal structure of NaFeO₂ and NaAlO₂ and their correlation with ionic conductivity.

Proskurnina N.V., Voronin V.I., Shekhtman G.S., Kabanova N. A. Crystal structure of NaFeO₂ and NaAlO₂ and their correlation with ionic conductivity. Ionics, 2020, 26 (6), 2917–2926. doi:10.1007/s11581-019-03387-6 IF 2.289

Метки: Natalya A. Kabanova, Q1, Samara University

19 декабря 2019 г.
Perceiving Zeolite Self-Assembly: a Combined Top-Down and Bottom-Up Approach within the Tiling Model.

Andrey A. Golov, Olga A. Blatova, Vladislav A. Blatov Perceiving Zeolite Self-Assembly: a Combined Top-Down and Bottom-Up Approach within the Tiling Model. The Journal of Physical Chemistry C, 2020, 124, 2, 1523-1528. doi: 10.1021/acs.jpcc.9b10514 IF 4.309

Метки: Olga A. Blatova, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

3 декабря 2019 г.
A Breathing Metal-Organic Framework Based on Flexible Inorganic Building Units.

Erik Svensson, Grape Hongyi Xu,Ocean Cheung, Marion Calmels, Jingjing Zhao, Catherine Dejoie, Davide M. Proserpio, Xiaodong Zou, A. Ken Inge A Breathing Metal-Organic Framework Based on Flexible Inorganic Building Units. Crystal Growth & Design, 2020, 20 (1), 320-329. doi: 10.1021/acs.cgd.9b01266 IF 3.972

Метки: Davide M. Proserpio, Q1, Samara State Technical University

18 ноября 2019 г.
Ionic Transport in Doped Solid Electrolytes by Means of DFT Modeling and ML Approaches: A Case Study of Ti-Doped KFeO₂.

Roman A. Eremin, Pavel N. Zolotarev, Andrey A. Golov, Nadezhda A. Nekrasova, Tilmann Leisegang Ionic Transport in Doped Solid Electrolytes by Means of DFT Modeling and ML Approaches: A Case Study of Ti-Doped KFeO₂. The Journal of Physical Chemistry C, 2019. doi: 10.1021/acs.jpcc.9b07535 IF 4.484

Метки: Nadezhda A. Nekrasova, Pavel N. Zolotarev, Q1, Samara State Technical University, Samara University

6 ноября 2019 г.
Anion-directed assembly of three cationic silver(I) coordination polymers with bis(imidazolyl)-based linker: Structural characterization and anion exchange study.

Sara Azizzadeh, Valiollah Nobakht, Lucia Carlucci, Davide M. Proserpio Anion-directed assembly of three cationic silver(I) coordination polymers with bis(imidazolyl)-based linker: Structural characterization and anion exchange study. Polyhedron, 2019, 175, 114236. doi: 10.1016/j.poly.2019.114236 IF 2.067

Метки: Davide M. Proserpio, Q2, Samara State Technical University

17 октября 2019 г.
From clusters to crystals: scale chemistry of intermetallics.

Vladimir Ya. Shevchenko, Inna V. Medrish, Gregory D. Ilyushin, Vladislav A. Blatov From clusters to crystals: scale chemistry of intermetallics. Structural Chemistry, 2019, 30 (6), 2015–2027. doi: 10.1007/s11224-019-01427-5 IF 1.624

Метки: Inna V. Medrish, Q2, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

7 октября 2019 г.
A universal algorithm for finding the shortest distance between systems of points.

I. A. Blatov, E. V. Kitaeva, A. P. Shevchenko and V. A. Blatov A universal algorithm for finding the shortest distance between systems of points. Acta Crystallographica Section A, 2019, 75 (6), 827-832. doi:10.1107/S2053273319011628 IF 4.647

Метки: Alexander P. Shevchenko, Q1, Samara State Technical University, Samara University, Vladislav A. Blatov

23 сентября 2019 г.
Anisotropy of Elastic Properties of Metal–Organic Frameworks and the Breathing Phenomenon.

Eugeny V. Alexandrov, Andrey V. Goltsev, Roman A. Eremin, Vladislav A. Blatov Anisotropy of Elastic Properties of Metal–Organic Frameworks and the Breathing Phenomenon. The Journal of Physical Chemistry C, 2019, 123, 40, 24651-24658. doi: 10.1021/acs.jpcc.9b08434 IF 4.484

Метки: Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

23 сентября 2019 г.
Modeling of Ionic Conductivity in Inorganic Compounds with Multivalent Cations.

E. A. Morkhova, A. A. Kabanov, V. A. Blatov Modeling of Ionic Conductivity in Inorganic Compounds with Multivalent Cations. Russian Journal of Electrochemistry, 2019, 55 (8), 762–777. doi: 10.1134/S102319351908010X IF 1.043

Метки: Artem A. Kabanov, Q3, Samara State Technical University, Samara University, Vladislav A. Blatov, Yelizaveta A. Morkhova

9 сентября 2019 г.
Diversifying molecular and topological space via a supramolecular solid-state synthesis: a purely organic mok net sustained by hydrogen bonds.

Shalisa M. Oburn, Michael A. Sinnwell, Devin P. Ericson, Eric W. Reinheimer, Davide M. Proserpio, Ryan H. Groeneman and Leonard MacGillivray Diversifying molecular and topological space via a supramolecular solid-state synthesis: a purely organic mok net sustained by hydrogen bonds. IUCrJ, 2019, 6. doi: 10.1107/S2052252519011382 IF 5.434

Метки: Davide M. Proserpio, Q1, Samara State Technical University

3 сентября 2019 г.
Predicting superhard materials via a machine learning informed evolutionary structure search.

Patrick Avery, Xiaoyu Wang, Corey Oses, Eric Gossett, Davide M. Proserpio, Cormac Toher, Stefano Curtarolo and Eva Zurek Predicting superhard materials via a machine learning informed evolutionary structure search. Computational Materials (Nature Partner Journals), 2019, 5, 89. doi: 10.1038/s41524-019-0226-8 IF 9.651

Метки: Davide M. Proserpio, Q1, Samara State Technical University

16 августа 2019 г.
From Topological Descriptors to Expert Systems: A Route to Predictable Materials.

Alexander P. Shevchenko, Eugeny V. Alexandrov, Olga A. Blatova, Denis E. Yablokov, Vladislav A. Blatov From Topological Descriptors to Expert Systems: A Route to Predictable Materials. In Materials Informatics: Methods, Tools and Applications, 107–147. doi: 10.1002/9783527802265.ch4

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Northwestern Polytechnical University, Olga A. Blatova, Samara University, Vladislav A. Blatov

4 августа 2019 г.
Diverse π–π stacking motifs modulate electrical conductivity in tetrathiafulvalene-based metal–organic frameworks.

Lilia Xie, Eugeny V. Alexandrov, Grigorii Skorupskii, Davide M Proserpio and Mircea Dinca Diverse π–π stacking motifs modulate electrical conductivity in tetrathiafulvalene-based metal–organic frameworks. Chemical Science, 2019, 10 (37), 8558-8565. doi:10.1039/C9SC03348C IF 9.556

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University

25 июля 2019 г.
Two Novel Self-Catenated Metal-Organic Frameworks with Large Accessible Channels Obtained by Mixed-Ligand Strategy: Adsorption of Dichromate and Ln3+-Post Synthetic Modification.

Yingying Sun, Ruidan Ma, Fengyuan Wang, Xianmin Guo, Shaowen Sun, Huadong Guo, Eugeny V. Alexandrov Two Novel Self-Catenated Metal-Organic Frameworks with Large Accessible Channels Obtained by Mixed-Ligand Strategy: Adsorption of Dichromate and Ln3+-Post Synthetic Modification. Crystal Growth & Design, 2019, 19 (9),5267–5274. doi: 10.1021/acs.cgd.9b00657 IF 3.972

Метки: Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University

22 июля 2019 г.
Assembly of two novel self-catenated metal-organic frameworks from a tripodal N, O-donor ligand: syntheses, structures and properties.

Ruidan Ma, Xianmin Guo, Yingying Sun, Fengyuan Wang, Shaowen Sun, Ting Zhou, Shuang Liu, Huadong Guo, Eugeny V. Alexandrov Assembly of two novel self-catenated metal-organic frameworks from a tripodal N, O-donor ligand: syntheses, structures and properties. Inorganica Chimica Acta, 2019, 496, 119032. doi: 10.1016/j.ica.2019.119032 IF 2.264

Метки: Eugeny V. Alexandrov, Q2, Samara State Technical University, Samara University

27 июня 2019 г.
Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion.

Xuanfeng Jiang, Xunzhe Cui, Andrew J. E. Duncan, Liang Li, Russell P. Hughes, Richard J. Staples, Eugeny V. Alexandrov, Davide M. Proserpio, Yuyang Wu, Chenfeng Ke Topochemical Synthesis of Single-Crystalline Hydrogen-Bonded Cross-Linked Organic Frameworks and Their Guest-Induced Elastic Expansion. Journal of the American Chemical Society, 2019, 141 (27),10915–10923. doi: 10.1021/jacs.9b05232 IF 14.695

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University

19 июня 2019 г.
Construction of (3,8)-connected three-dimensional cobalt(II) and copper(II) coordination polymers with 1,3-bis[(1,2,4-triazol-4-yl)methyl]benzene and benzene-1,3,5-tricarboxylate ligands.

Y.-Q. Zhang, V. A. Blatov, X.-X. Lv, D.-Y. Tang, L.-L. Qian, K. Li and B.-L. Li Construction of (3,8)-connected three-dimensional cobalt(II) and copper(II) coordination polymers with 1,3-bis[(1,2,4-triazol-4-yl)methyl]benzene and benzene-1,3,5-tricarboxylate ligands. Acta Crystallographica Section C, 2019, 75, 960-968. doi:10.1107/S205322961900826X IF 4.36

Метки: Q1, Samara University, Vladislav A. Blatov

3 июня 2019 г.
A New sp²-sp³-Hybridized Metallic Carbon Network for Lithium-ion Battery Anode with Enhanced Safety and Lithium-ion Diffusion Rate.

Dong Fan, Andrey A. Golov, Artem A. Kabanov, Chengke Chen, Shaohua Lu, Xiao Li, Meiyan Jiang, Xiaojun Hu A New sp²-sp³-Hybridized Metallic Carbon Network for Lithium-ion Battery Anode with Enhanced Safety and Lithium-ion Diffusion Rate. The Journal of Physical Chemistry C, 2019, 123 (25),15412–15418. doi: 10.1021/acs.jpcc.9b02034 IF 4.484

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University

23 мая 2019 г.
Empirical Electronic Polarizabilities: Deviations from the Additivity Rule. II. Structures Exhibiting Ion Conductivity.

Robert D. Shannon, Natalia A. Kabanova, Reinhard X. Fischer Empirical Electronic Polarizabilities: Deviations from the Additivity Rule. II. Structures Exhibiting Ion Conductivity. Crystal Research & Technology, 2019, 54 (7), 1900037. doi: 10.1002/crat.201900037 IF 1.122

Метки: Natalya A. Kabanova, Q2, Samara State Technical University

1 мая 2019 г.
The Aluminum-Ion Battery: A Sustainable and Seminal Concept?.

Tilmann Leisegang, Falk Meutzner, Matthias Zschornak, Wolfram Münchgesang, Robert Schmid, Tina Nestler, Roman A. Eremin, Artem A. Kabanov, Vladislav A. Blatov and Dirk C. Meyer The Aluminum-Ion Battery: A Sustainable and Seminal Concept? Frontier in Chemistry, 2019. doi: 10.3389/fchem.2019.00268 IF 4.155

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University, Vladislav A. Blatov

23 апреля 2019 г.
Sulphur‐ and selenium‐containing compounds potentially exhibiting Al‐ion conductivity.

F. Meutzner, M. Zschornak, A. Kabanov, T. Nestler, T. Leisegang, V. A. Blatov, D. C. Meyer Sulphur‐ and selenium‐containing compounds potentially exhibiting Al‐ion conductivity. Chemistry – A European Journal, 2019, 25 (36), 8623–8629. doi: 10.1002/chem.201901438 IF 5.160

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University, Vladislav A. Blatov

18 апреля 2019 г.
Novel Heterometallic Uranyl-Transition Metal Materials: Structure, Topology, and Solid State Photoluminescence Properties.

Germán E. Gomez, J. August Ridenour, Nicole M. Byrne, Alexander P. Shevchenko, and Christopher L. Cahill Novel Heterometallic Uranyl-Transition Metal Materials: Structure, Topology, and Solid State Photoluminescence Properties. Inorganic Chemistry, 2019, 58, 11, 7243-7254. doi: 10.1021/acs.inorgchem.9b00255 IF 4.700

Метки: Alexander P. Shevchenko, Q1, Samara University

12 апреля 2019 г.
Network topological model of reconstructive solid-state transformations.

Vladislav A. Blatov, Andrey A. Golov, Changhao Yang, Qingfeng Zeng & Artem A. Kabanov Network topological model of reconstructive solid-state transformations. Scientific Reports, 2019, 9. doi:10.1038/s41598-019-42483-5 IF 4.122

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

12 апреля 2019 г.
Sonochemical synthesis and characterization of four nanostructural nickel coordination polymers and photocatalytic degradation of methylene blue.

Lin-Lu Qian, Vladislav A. Blatov, Zhi-Xiang Wang, Jian-Gang Ding, Li-Ming Zhu, Ke Li, Bao-Long Li, Bing Wu Sonochemical synthesis and characterization of four nanostructural nickel coordination polymers and photocatalytic degradation of methylene blue. Ultrasonics Sonochemistry, 2019, 56, 213-228. doi: 10.1016/j.ultsonch.2019.04.015 IF 6.12

Метки: Q1, Samara State Technical University, Samara University, Vladislav A. Blatov

2 апреля 2019 г.
Topological databases: why do we need them for design of coordination polymers?.

Eugeny V. Alexandrov, Alexander Shevchenko, and Vladislav A. Blatov Topological databases: why do we need them for design of coordination polymers? Crystal Growth & Design, 2019, 19 (5), pp 2604–2614. doi: 10.1021/acs.cgd.8b01721 IF 3.972

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

27 марта 2019 г.
Topology: ToposPro.

Vladislav A.Blatov, Eugeny V.Alexandrov, Alexander P.Shevchenko Topology: ToposPro. In Comprehensive Coordination Chemistry (Reference Module in Chemistry, Molecular Sciences and Chemical Engineering), 2019. doi: 10.1016/B978-0-12-409547-2.14576-7

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Samara State Technical University, Samara University, Vladislav A. Blatov

22 марта 2019 г.
Variation of Topologies and Entanglements in Metal-Organic Frameworks with mixed tris[4-(1H-imidazol-1-yl)phenyl]phosphine oxide and dicarboxylate ligands.

Yingying Sun, Xiaojie Chen, Fengyuan Wang, Ruidan Ma, Xianmin Guo, Shaowen Sun, Huadong Guo and Eugeny V. Alexandrov Variation of Topologies and Entanglements in Metal-Organic Frameworks with mixed tris[4-(1H-imidazol-1-yl)phenyl]phosphine oxide and dicarboxylate ligands. Dalton Transactions, 2019, 48 (16), 5450–5458. doi:10.1039/C9DT00249A IF 4.099

Метки: Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University

15 марта 2019 г.
Ab initio modeling of oxygen ion migration in non-stoichiometric bismuth titanate pyrochlore Bi_1.5Ti₂O_6.25.

A.G. Krasnov, A.A. Kabanov, N.A. Kabanova, I.V. Piir, I.R. Shein Ab initio modeling of oxygen ion migration in non-stoichiometric bismuth titanate pyrochlore Bi_1.5Ti₂O_6.25. Solid State Ionics, 2019, 335, 135-141. doi: 10.1016/j.ssi.2019.02.023 IF 2.751

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q1, Samara State Technical University, Samara University

15 февраля 2019 г.
Unique self-catenated 3D Cd(II)-MOF with a rare (3,3,9)-connected underlying network exhibiting high photocatalytic activities.

Wen-Chao Kang, Dong Liu, Vladislav A.Blatov, Guang-HuaCui Unique self-catenated 3D Cd(II)-MOF with a rare (3,3,9)-connected underlying network exhibiting high photocatalytic activities. Inorganic Chemistry Communications, 2019, 102, 126-129. doi: 10.1016/j.inoche.2019.02.017 IF 1.81

Метки: Q3, Samara State Technical University, Vladislav A. Blatov

no spine minimum. half size. Editor: Tara JEM: Esther
RTP: Cathy Fisher

20 января 2019 г.
A combined theoretical approach for identifying battery materials: Al3+ mobility in oxides.

T. Nestler, F. Meutzner, A.A. Kabanov, M. Zschornak, T. Leisegang, and D.C. Meyer A combined theoretical approach for identifying battery materials: Al3+ mobility in oxides. Chemistry of Materials, 2019, 31 (3), 737–747. doi: 10.1021/acs.chemmater.8b03631 IF 9.890

Метки: Artem A. Kabanov, Q1, Samara State Technical University, Samara University

22 декабря 2018 г.
Natural tilings and free space in zeolites: models, statistics, correlations, prediction.

Olga A. Blatova, Andrey A. Golov, Vladislav A. Blatov Natural tilings and free space in zeolites: models, statistics, correlations, prediction. Zeitschrift für Kristallographie - Crystalline Materials, 2019, 234 (7-8), 421–436. doi:10.1515/zkri-2018-2143 IF 2.159

Метки: Olga A. Blatova, Q2, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

20 октября 2018 г.
High-throughput search for potential potassium ion conductors: A combination of geometrical-topological and density functional theory approaches.

R.A.Eremin, N.A.Kabanova, Ye.A.Morkhova, A.A.Golov, V.A.Blatov High-throughput search for potential potassium ion conductors: A combination of geometrical-topological and density functional theory approaches. Solid State Ionics, 2018, 326, 188-199. doi: 10.1016/j.ssi.2018.10.009 IF 2.751

Метки: Natalya A. Kabanova, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov, Yelizaveta A. Morkhova

17 октября 2018 г.
Topology-based crystal structure generator.

Pavel V.Bushlanov, Vladislav A.Blatov, Artem R.Oganov Topology-based crystal structure generator. Computer Physics Communications, 2019, 236, 1-7. doi: 10.1016/j.cpc.2018.09.016 IF 3.748

Метки: Northwestern Polytechnical University, Q1, Samara State Technical University, Vladislav A. Blatov

17 октября 2018 г.
Water-Stable Fluorinated Metal−Organic Frameworks (F-MOFs) with Hydrophobic Properties as Efficient and Highly Active Heterogeneous Catalysts in Aqueous Solution.

M. Joharian, A. Azhdari Tehrani, A. Morsali, L. Carlucci, D. M. Proserpio Water-Stable Fluorinated Metal−Organic Frameworks (F-MOFs) with Hydrophobic Properties as Efficient and Highly Active Heterogeneous Catalysts in Aqueous Solution. Green Chemistry, 2018, 20, 5336-5345. doi: 10.1039/C8GC02367K IF 8.586

Метки: Davide M. Proserpio, Q1, Samara State Technical University

15 октября 2018 г.
Tailor‐Made Microporous Metal–Organic Frameworks for the Full Separation of Propane from Propylene Through Selective Size Exclusion.

Hao Wang, Xinglong Dong, Valentina Colombo, Qining Wang, Yanyao Liu, Wei Liu, Xin‐Long Wang, Xiao‐Ying Huang, Davide M. Proserpio, Angelo Sironi, Yu Han, Jing Li Tailor‐Made Microporous Metal–Organic Frameworks for the Full Separation of Propane from Propylene Through Selective Size Exclusion. Advanced Materials, 2018, 30 (49), e1805088. doi: 10.1002/adma.201805088 IF 21.950

Метки: Davide M. Proserpio, Q1, Samara State Technical University

12 октября 2018 г.
Assembly of Polynuclear Single‐molecule Magnets.

Kieran Griffiths, Vladislav A. Blatov, George E. Kostakis Assembly of Polynuclear Single‐molecule Magnets. In Single‐Molecule Magnets, M. Hołyńska (Ed.). doi:10.1002/9783527809929.ch8

Метки: Samara University, Vladislav A. Blatov

130 minimum on spine. Editor: Mihaela Rogers, JEM: Diane
RTP: Maureen Murdock

9 октября 2018 г.
Three Cationic Non-Porous CuI-Coordination Polymers: Structural Investigation and Vapor Iodine Capture.

Elham Baladi, Valiollah Nobakht, Abbas Tarassoli, Davide M. Proserpio, and Lucia Carlucci Three Cationic Non-Porous CuI-Coordination Polymers: Structural Investigation and Vapor Iodine Capture. Crystal Growth & Design, 2018, 18 (11), 7207-7218. doi: 10.1021/acs.cgd.8b01446 IF 3.972

Метки: Davide M. Proserpio, Q1, Samara State Technical University

no spine minimum. half size. Editor: Tamara Hanna JEM: Esther
RTP: Bryan Nolte

4 октября 2018 г.
Toward Engineering Chiral Rodlike Metal–Organic Frameworks with Rare Topologies.

Thais Grancha, Jesús Ferrando-Soria, Davide M. Proserpio, Donatella Armentano, and Emilio Pardo Toward Engineering Chiral Rodlike Metal–Organic Frameworks with Rare Topologies. Inorganic Chemistry, 2018, 57 (20), 12869–12875. doi: 10.1021/acs.inorgchem.8b02082 IF 4.700

Метки: Davide M. Proserpio, Q1, Samara State Technical University

4 октября 2018 г.
Autoluminescent Metal-Organic Frameworks: Self-Photoemission of a Highly Stable Thorium MOF.

Jacopo Andreo, Emanuele Priola, Gabriele Alberto, Paola Benzi, Domenica Marabello, Davide M. Proserpio, Carlo Lamberti, and Eliano Diana Autoluminescent Metal-Organic Frameworks: Self-Photoemission of a Highly Stable Thorium MOF. Journal of the American Chemical Society, 2018, 140 (43), 14144-14149. doI: 10.1021/jacs.8b07113 IF 14.357

Метки: Davide M. Proserpio, Q1, Samara State Technical University

2 октября 2018 г.
Computational analysis and identification of battery materials.

F. Meutzner, T. Nestler, M. Zschornak, P. Canepa, G. S. Gautam, S. Leoni, S. Adams, T. Leisegang, V. A. Blatov, D. C. Meyer Computational analysis and identification of battery materials. Physical Sciences Reviews, 2019, 4 (1), 20180044. doi:10.1515/psr-2018-0044 IF 1.414

Метки: Q1, Samara University, Vladislav A. Blatov

21 сентября 2018 г.
Ultrasound and solvothermal synthesis of a new urea-based metal-organic framework as a precursor for fabrication of cadmium(II) oxide nanostructures.

Leili Esrafili, Alireza Azhdari Tehrani, Ali Morsali, Lucia Carlucci, Davide M. Proserpio Ultrasound and solvothermal synthesis of a new urea-based metal-organic framework as a precursor for fabrication of cadmium(II) oxide nanostructures. Inorganica Chimica Acta, 2019, 484, 386-393. doi:10.1016/j.ica.2018.09.025 IF 2.264

Метки: Davide M. Proserpio, Q2, Samara State Technical University

20 сентября 2018 г.
D-carbon: Ab initio study of a novel carbon allotrope.

Dong Fan, Shaohua Lu, Andrey A. Golov, Artem A. Kabanov and Xiaojun Hu D-carbon: Ab initio study of a novel carbon allotrope. The Journal of Chemical Physics, 2018, 149, 114702. doi: 10.1063/1.5037380 IF 2.843

Метки: Artem A. Kabanov, Q1, Samara University

28 августа 2018 г.
Construction of five zinc coordination polymers with 4-substituted bis(trizole) and multicarboxylate ligands: Syntheses, structures and properties.

Ya-Qian Zhang, Vladislav A. Blatov, Xiu-Xiu Lv, Chang-Hao Yang, Lin-Lu Qian, Ke Li, Bao-Long Li, Bing Wu Construction of five zinc coordination polymers with 4-substituted bis(trizole) and multicarboxylate ligands: Syntheses, structures and properties. Polyhedron, 2018, 155, 223-231. doi: 10.1016/j.poly.2018.08.047 IF 2.067

Метки: Northwestern Polytechnical University, Q2, Samara University, Vladislav A. Blatov

28 августа 2018 г.
Generating carbon schwarzites via zeolite-templating.

Efrem Braun, Yongjin Lee, Seyed Mohamad Moosavi, Senja Barthel, Rocio Mercado, Igor A. Baburin, Davide M. Proserpio, and Berend Smit Generating carbon schwarzites via zeolite-templating. Proceedings of the National Academy of Sciences, 2018, 115 (35), E8116-E8124. doi:10.1073/pnas.1805062115 IF 9.504

Метки: Davide M. Proserpio, Q1, Samara State Technical University

18 августа 2018 г.
Construction of Cd(II) coordination polymers from a fluorene-based bisimidazole ligand and polycarboxylic acids: syntheses, structures and properties.

Sh. Sun, Y. Sun, H. Guo, X. Fu, M. Guo, S. Liu, X. Guo, L. Zhang, E. V. Alexandrov Construction of Cd(II) coordination polymers from a fluorene-based bisimidazole ligand and polycarboxylic acids: syntheses, structures and properties. Inorganica Chimica Acta, 2018, 483, 165–172. doi: 10.1016/j.ica.2018.08.018 IF 2.264

Метки: Eugeny V. Alexandrov, Q2, Samara State Technical University, Samara University

11 августа 2018 г.
Electrodes: definitions and systematisation – a crystallographers view.

Falk Meutzner, Matthias Zschornak, Melanie Nentwich, Damien Monti, Tilmann Leisegang Electrodes: definitions and systematisation – a crystallographers view. Physical Sciences Reviews, 2018, 3, 10. doi:10.1515/psr-2018-0043 IF 1.414

Метки: Samara University

7 мая 2018 г.
Deconstruction of Crystalline Networks into Underlying Nets: Relevance for Terminology Guidelines and Crystallographic Databases.

Charlotte Bonneau, Michael O'Keeffe, Davide M. Proserpio, Vladislav A. Blatov, Stuart R. Batten, Susan A. Bourne, Myoung Soo Lah, Jean-Guillaume Eon, Stephen T Hyde, Seth B. Wiggin, and Lars Ohrstrom Deconstruction of Crystalline Networks into Underlying Nets: Relevance for Terminology Guidelines and Crystallographic Databases. Crystal Growth & Design, 2018, 18 (6), 3411–3418. doi: 10.1021/acs.cgd.8b00126 IF 3.972

Метки: Davide M. Proserpio, Q1, Samara University, Vladislav A. Blatov

5 мая 2018 г.
Lu₅Pd₄Ge₈ and Lu₃Pd₄Ge₄: Two More Germanides among Polar Intermetallics.

Riccardo Freccero, Pavlo Solokha, Davide Maria Proserpio, Adriana Saccone and Serena De Negri Lu₅Pd₄Ge₈ and Lu₃Pd₄Ge₄: Two More Germanides among Polar Intermetallics. Crystals, 2018, 8(5), 205. doi: 10.3390/cryst8050205 IF 2.144

Метки: Davide M. Proserpio, Q2, Samara State Technical University

1 мая 2018 г.
Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers.

Hao Wang, Xinglong Dong, Junzhong Lin, Simon J. Teat, Stephanie Jensen, Jeremy Cure, Eugeny V. Alexandrov, Qibin Xia, Kui Tan, Qining Wang, David H. Olson, Davide M. Proserpio, Yves J. Chabal, Timo Thonhauser, Junliang Sun, Yu Han & Jing Li Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers. Nature Communications, 2018, 9, 1745. doi: 10.1038/s41467-018-04152-5 IF 12.353

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara University

12 апреля 2018 г.
Data-driven learning and prediction of inorganic crystal structures.

Volker L. Deringer, Davide M. Proserpio, Gábor Csányi and Chris J. Pickard Data-driven learning and prediction of inorganic crystal structures. Faraday Discussions, 2018, 211, 45-59. doi:10.1039/C8FD00034D IF 3.427

Метки: Davide M. Proserpio, Q1, Samara State Technical University

7 апреля 2018 г.
An unusual (4,6)-coordinated copper(II) coordination polymer: High efficient degradation of organic dyes under visible light irradiation and electrochemical properties.

Tian-Rui Zheng, Vladislav A. Blatov, Lin-Lu Qian, Ding-Yi Tang, Ya-Qian Zhang, Zhi-Xiang Wang, Bao-Long Li, Bin Wu An unusual (4,6)-coordinated copper(II) coordination polymer: High efficient degradation of organic dyes under visible light irradiation and electrochemical properties. Polyhedron, 2018, 148, 81-87. doi:10.1016/j.poly.2018.03.032 IF 2.067

Метки: Northwestern Polytechnical University, Q2, Samara University, Vladislav A. Blatov

4 апреля 2018 г.
A luminescent zinc(II) coordination polymer with unusual (3,4,4)-coordinated self-catenated 3D network for selective detection of nitroaromatics and ferric and chromate ions: a versatile luminescent sensor.

Ya-Qian Zhang, Vladislav A. Blatov, Tian-Rui Zheng, Chang-Hao Yang, Lin-Lu Qian, Ke Li, Bao-Long Li and Bing Wu A luminescent zinc(II) coordination polymer with unusual (3,4,4)-coordinated self-catenated 3D network for selective detection of nitroaromatics and ferric and chromate ions: a versatile luminescent sensor. Dalton Transactions, 2018, 47, 6189-6198. doi:10.1039/C7DT04682K IF 4.099

Метки: Northwestern Polytechnical University, Q1, Samara University, Vladislav A. Blatov

4 апреля 2018 г.
Predicting new zeolites: a combination of thermodynamic and kinetic factors.

Ekaterina D. Kuznetsova, Olga A. Blatova and Vladislav A. Blatov Predicting new zeolites: a combination of thermodynamic and kinetic factors. Chemistry of Materials, 2018, 30 (8), 2829–2837. doi: 10.1021/acs.chemmater.8b00905 IF 9.890

Метки: Olga A. Blatova, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

14 марта 2018 г.
An unusual (3,10)-coordinated 3D network coordination polymer as a potential luminescent sensor for detection of nitroaromatics and ferric ion.

Tian-Rui Zheng, Vladislav A. Blatov, Ya-Qian Zhang, Chang-Hao Yang, Lin-Lu Qian, Ke Li, Bao-Long Li, Bing Wu An unusual (3,10)-coordinated 3D network coordination polymer as a potential luminescent sensor for detection of nitroaromatics and ferric ion. Journal of Luminescence, 2018, 199, 126–132. doi: 10.1016/j.jlumin.2018.03.025 IF 2.732

Метки: Northwestern Polytechnical University, Q2, Samara University, Vladislav A. Blatov

5 марта 2018 г.
Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion.

M. A. Harvey, S. Suarez, P. N. Zolotarev, D. M. Proserpio and R. Baggio Topological study of diverse hydrogen-bonded patterns found in a system of a nickel(II) complex and the sulfate anion. Acta Crystallographica Section C, 2018, 74, 351-359. doi: 10.1107/S2053229618002413 IF 8.678

Метки: Davide M. Proserpio, Pavel N. Zolotarev, Samara State Technical University

20 февраля 2018 г.
Vacuum-Mediated Single-Crystal-to-Single-Crystal (SCSC) Transformation in Na-MOFs: Rare to Novel Topology and Activation of Nitrogen in Triazole Moieties.

Shagufi Naz Ansari, Sanjay K. Verma, Aleksandr A. Garin, and Shaikh M. Mobin Vacuum-Mediated Single-Crystal-to-Single-Crystal (SCSC) Transformation in Na-MOFs: Rare to Novel Topology and Activation of Nitrogen in Triazole Moieties.Crystal Growth & Design, 2018, 18 (3), 1287-1292. doi: 10.1021/acs.cgd.7b01753 IF 3.972

Метки: Q1, Samara University

2 февраля 2018 г.
Coordination polymers from bent ligands or how to obtain rare topologies with simple linkers and nodes.

Siyu Liu, Mingming Guo, Yingying Sun, Huadong Guo, Xianmin Guo, Eugeny Alexandrov Coordination polymers from bent ligands or how to obtain rare topologies with simple linkers and nodes. Inorganica Chimica Acta, 2018, 474, 73–80. doi: 10.1016/j.ica.2018.01.018 IF 2.264

Метки: Eugeny V. Alexandrov, Q2, Samara University

25 января 2018 г.
Distinguishing metal-organic frameworks.

Senja Barthel, Eugeny V. Alexandrov, Davide M. Proserpio and Berend Smit Distinguishing metal-organic frameworks. Crystal Growth & Design, 2018, 18 (3), 1738–1747. doi: 10.1021/acs.cgd.7b01663 IF 3.972

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, Samara State Technical University, Samara University

23 января 2018 г.
Structural diversity of six metal–organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes.

Siyu Liu, Mingming Guo, Huadong Guo, Yingying Sun, Xianmin Guo, Shaowen Suna and Eugeny V. Alexandrov Structural diversity of six metal–organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes. RSC Advances, 2018, 8, 4039-4048. doi:10.1039/C7RA11754J IF 3.096

Метки: Eugeny V. Alexandrov, Q1, Samara University

29 декабря 2017 г.
Topology of Intermetallic Structures: From Statistics to Rational Design.

Tatiana G. Akhmetshina, Vladislav A. Blatov, Davide M. Proserpio, and Alexander P. Shevchenko Topology of Intermetallic Structures: From Statistics to Rational Design. Accounts of Chemical Research, 2018, 51 (1), 21–30. doi: 10.1021/acs.accounts.7b00466 IF 20.955

Метки: Alexander P. Shevchenko, Davide M. Proserpio, Q1, Samara State Technical University, Samara University, ToposPro, Vladislav A. Blatov

no spine minimum. full size. Editor: Barbara Sydow JEM: Clay
RTP: Donna Bone, Maureen Murdock
jpccck

30 ноября 2017 г.
Li(Ni,Co,Al)O₂ Cathode Delithiation: A Combination of Topological Analysis, Density Functional Theory, Neutron Diffraction and Machine Learning Techniques.

Roman A. Eremin, Pavel N. Zolotarev, Olga Yu. Ivanshina, and Ivan A. Bobrikov Li(Ni,Co,Al)O₂ Cathode Delithiation: A Combination of Topological Analysis, Density Functional Theory, Neutron Diffraction and Machine Learning Techniques, The Journal of Physical Chemistry C, 2017, 121 (51), 28293–28305. doi: 10.1021/acs.jpcc.7b09760 IF 4.484

Метки: Pavel N. Zolotarev, Q1

14 ноября 2017 г.
Crystallochemical tools in the search for cathode materials of rechargeable Na-ion batteries and analysis of their transport properties.

Stanislav S. Fedotov, Natalya A. Kabanova, Artem A. Kabanov, Vladislav A. Blatov, Nellie R. Khasanova, Evgeny V. Antipov Crystallochemical tools in the search for cathode materials of rechargeable Na-ion batteries and analysis of their transport properties. Solid State Ionics, 2018, 314, 129–140. doi: 10.1016/j.ssi.2017.11.008 IF 2.354

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q1, ToposPro, Vladislav A. Blatov

16 октября 2017 г.
Packing topology in crystals of proteins and small molecules: a comparison.

Oliviero Carugo, Olga A. Blatova, Elena O. Medrish, Vladislav A. Blatov & Davide M. Proserpio Packing topology in crystals of proteins and small molecules: a comparison. Scientific Reports, 2017, 7. doi:10.1038/s41598-017-12699-4 IF 4.525

Метки: Davide M. Proserpio, Olga A. Blatova, Q1, ToposPro, Vladislav A. Blatov

21 сентября 2017 г.
A Water-Stable Cl@Ag₁₄ Cluster Based Metal−Organic Open Framework for Dichromate Trapping and Bacterial Inhibition.

Shan-Shan Zhang, Xin Wang, Hai-Feng Su, Lei Feng, Zhi Wang, Wen-Qiang Ding, Vladislav A. Blatov, Mohamedally Kurmoo, Chen-Ho Tung, Di Sun, and Lan-Sun Zheng A Water-Stable Cl@Ag₁₄ Cluster Based Metal−Organic Open Framework for Dichromate Trapping and Bacterial Inhibition. Inorganic Chemistry, 2017, 56 (19), 11891–11899. doi: 10.1021/acs.inorgchem.7b01879 IF 4.700

Метки: Q1, Vladislav A. Blatov

21 сентября 2017 г.
A 3D Coordination Network Built from Cu^II₄Cl₃(H₂O)₂ Linear Clusters and Tetrapyridyl Tetrahedral Silane Ligands: Reversible Iodine Uptake and Friedel–Crafts Alkylation Reactions.

Mahesh S. Deshmukh, Atul Chaudhary, Pavel N. Zolotarev, and Ramamoorthy Boomishankar A 3D Coordination Network Built from Cu^II₄Cl₃(H₂O)₂ Linear Clusters and Tetrapyridyl Tetrahedral Silane Ligands: Reversible Iodine Uptake and Friedel–Crafts Alkylation Reactions. Inorganic Chemistry, 2017, 56 (19), 11762–11767. doi: 10.1021/acs.inorgchem.7b01781 IF 4.700

Метки: Pavel N. Zolotarev, Q1

18 сентября 2017 г.
A new glance on the R₂MGe₆ (R = rare earth metal, M=another metal) compounds. An experimental and theoretical study of R₂PdGe₆ germanides.

Riccardo Freccero, Pavlo Solokha, Davide M Proserpio, Adriana Saccone and Serena De Negri A new glance on the R₂MGe₆ (R = rare earth metal, M=another metal) compounds. An experimental and theoretical study of R₂PdGe₆ germanides. Dalton Transactions, 2017, 40, 14021-14033. doi:10.1039/C7DT02686B IF 4.099

Метки: Davide M. Proserpio, Q1

11 сентября 2017 г.
Capture of volatile iodine by newly prepared and characterized non-porous [CuI]n-based coordination polymers.

A. Tarassoli, V. Nobakht, E. Baladi, L. Carlucci and D. M. Proserpio Capture of volatile iodine by newly prepared and characterized non-porous [CuI]n-based coordination polymers, CrystEngComm, 2017, 41 (19), 6116–6126 doi: 10.1039/C7CE01193H IF 3.382

Метки: Davide M. Proserpio, Q1

11 сентября 2017 г.
A series of Cd(II) coordination polymers based on flexible bis(triazole) and multicarboxylate ligands: topological diversity, entanglement and properties.

Ke Li, Vladislav A. Blatov, Tao Fan, Tian-Rui Zheng, Ya-Qian Zhang, Bao-Long Li and Bing Wu A series of Cd(II) coordination polymers based on flexible bis(triazole) and multicarboxylate ligands: topological diversity, entanglement and properties. CrystEngComm, 2017, 38 (19), 5797-5808. doi: 10.1039/C7CE01176H IF 3.382

Метки: Q1, Vladislav A. Blatov

11 сентября 2017 г.
Ionic Conductivity in Ti-Doped KFeO₂: Experiment and Mathematical Modeling.

Natalia Vladimirovna Proskurnina, Vladimir I. Voronin, Georgi Sh. Shekhtman, Larisa Nikolaevna Maskaeva, Natalia A. Kabanova, Artem A. Kabanov, and Vladislav A. Blatov Ionic Conductivity in Ti-Doped KFeO₂: Experiment and Mathematical Modeling. The Journal of Physical Chemistry C, 2017, 121 (39), 21128–21135. doi: 10.1021/acs.jpcc.7b05164 IF 4.484

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q1, Vladislav A. Blatov

9 августа 2017 г.
Ab initio study of new sp³ silicon and germanium allotropes predicted from the zeolite topologies.

Vladimir A. Saleev, Alexandra V. Shipilova, Davide M. Proserpio, and Giuseppe Fadda Ab initio study of new sp³ silicon and germanium allotropes predicted from the zeolite topologies, The European Physical Journal B, 2017, 90, 150. doi: 10.1140/epjb/e2017-80152-2 IF 1.465

Метки: Davide M. Proserpio, Q2

27 июня 2017 г.
Bonding analyses of unconventional carbon allotropes.

Marc Esser, Arina A. Esser, Davide M. Proserpio, Richard Dronskowski Bonding analyses of unconventional carbon allotropes. Carbon, 2017, 121, 154 – 162. doi:10.1016/j.carbon.2017.05.062 IF 7.466

Метки: Davide M. Proserpio, Q1

19 мая 2017 г.
Two Exceptional Patterns of Helical Secondary Building Units Found in Metal–Organic Framework Structures.

Eugeny V. Alexandrov, Andrey V. Goltsev, Michael O’Keeffe, and Davide M. Proserpio Two Exceptional Patterns of Helical Secondary Building Units Found in Metal–Organic Framework Structures. Crystal Growth & Design, 2017, 17 (6), 2941–2944. doi: 10.1021/acs.cgd.7b00430 IF 3.972

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1

27 апреля 2017 г.
Self-assembly of three cationic silver(I) coordination networks with flexible bis(pyrazolyl)-based linkers.

Sara Azizzadeh, Valiollah Nobakht, Lucia Carlucci, Davide M. Proserpio Self-assembly of three cationic silver(I) coordination networks with flexible bis(pyrazolyl)-based linkers. Polyhedron, 2017, 130, 58 – 66. doi: 10.1016/j.poly.2017.03.048 IF 2.067

Метки: Davide M. Proserpio, Q2

27 апреля 2017 г.
Predicting crystal growth via a unified kinetic three-dimensional partition model.

Michael W. Anderson, James T. Gebbie-Rayet, Adam R. Hill, Nani Farida, Martin P. Attfield,Pablo Cubillas, Vladislav A. Blatov, Davide M. Proserpio, Duncan Akporiaye, Bjørnar Arstad & Julian D. Gale Predicting crystal growth via a unified kinetic three-dimensional partition model. Nature, 2017, 544, 456–459. doi:10.1038/nature21684 IF 41.577

Метки: Davide M. Proserpio, Q1, ToposPro, Vladislav A. Blatov

19 апреля 2017 г.
Extracting Crystal Chemistry from Amorphous Carbon Structures.

Volker L. Deringer, Gabor Csanyi, and Davide M. Proserpio Extracting Crystal Chemistry from Amorphous Carbon Structures. ChemPhysChem 2017, 18 (8), 873–877. doi: 10.1002/cphc.201700151 IF 3.075

Метки: Davide M. Proserpio, Q1

7 апреля 2017 г.
Quantitative structure–Chromatographic retention correlations of quinoline derivatives.

Nadezhda A. Nekrasova, Svetlana V. Kurbatova Quantitative structure–Chromatographic retention correlations of quinoline derivatives. Journal of Chromatography A, 2017, 55–60. doi:10.1016/j.chroma.2017.02.063 IF 4.169

Метки: Nadezhda A. Nekrasova, Q1

5 апреля 2017 г.
Self-Catenated Coordination Polymers Involving Bis-pyridyl-bis-amide.

Hsiu-Yi He, Chih-Hsun Hsu, Han-Yun Chang, Xiang-Kai Yang, Pradhumna Mahat Chhetri, Davide M. Proserpio, and Jhy-Der Chen Self-Catenated Coordination Polymers Involving Bis-pyridyl-bis-amide. Crystal Growth & Design, 2017, 17 (4), 1991–1998. doi: 10.1021/acs.cgd.7b00001 IF 3.972

Метки: Davide M. Proserpio, Q1

15 марта 2017 г.
How 2-periodic coordination networks are interweaved: entanglement isomerism and polymorphism.

Eugeny V. Alexandrov, Vladislav A. Blatov and Davide M. Proserpio How 2-periodic coordination networks are interweaved: entanglement isomerism and polymorphism. CrystEngComm, 2017, 19 (15), 1993-2006. doi: 10.1039/C7CE00313G IF 3.382

Метки: Davide M. Proserpio, Eugeny V. Alexandrov, Q1, ToposPro, Vladislav A. Blatov

11 марта 2017 г.
Topological methods for complex intermetallics.

Akhmetshina T.G., Blatov V.A. Topological methods for complex intermetallics. Zeitschrift für Kristallographie, 2017, 232 (7-9), 497-506. doi: 10.1515/zkri-2016-2027 IF 2.159

Метки: Q2, Vladislav A. Blatov

19 февраля 2017 г.
Crystal Structure and Li-Ion Transport in Li₂CoPO₄F High-Voltage Cathode Material for Li-Ion Batteries.

Stanislav S. Fedotov, Artem A. Kabanov, Natalia A. Kabanova, Vladislav A. Blatov, Andriy Zhugayevych, Artem M. Abakumov, Nellie R. Khasanova, and Evgeny V. Antipov Crystal Structure and Li-Ion Transport in Li₂CoPO₄F High-Voltage Cathode Material for Li-Ion Batteries. The Journal of Physical Chemistry C, 2017, 121 (6), 3194–3202. doi: 10.1021/acs.jpcc.6b11027 IF 4.484

Метки: Artem A. Kabanov, Natalya A. Kabanova, Q1, ToposPro, Vladislav A. Blatov

16 февраля 2017 г.
Urea Metal–Organic Frameworks for Nitro-Substituted Compounds Sensing.

Alireza Azhdari Tehrani, Leili Esrafili, Sedigheh Abedi, Ali Morsali, Lucia Carlucci, Davide M. Proserpio, Jun Wang, Peter C. Junk, and Tianfu Liu Urea Metal–Organic Frameworks for Nitro-Substituted Compounds Sensing. Inorganic Chemistry, 2017, 56 (3), 1446–1454. doi: 10.1021/acs.inorgchem.6b02518 IF 4.700

Метки: Davide M. Proserpio, Q1

6 февраля 2017 г.
Local Coordination versus Overall Topology in Crystal Structures: Deriving Knowledge from Crystallographic Databases.

Alexander P. Shevchenko, Igor A. Blatov, Elena V. Kitaeva, and Vladislav A. Blatov Local Coordination versus Overall Topology in Crystal Structures: Deriving Knowledge from Crystallographic Databases. Crystal Growth & Design, 2017, 17 (2), 774–785. doi: 10.1021/acs.cgd.6b01630 IF 3.972

Метки: Alexander P. Shevchenko, Q1, ToposPro, Vladislav A. Blatov

12 января 2017 г.
A fascinating building unit: Mackay cluster in intermetallics.

T. G. Akhmetshina T. G., Blatov V. A. A fascinating building unit: Mackay cluster in intermetallics. Structural Chemistry, 2017, 28 (1), 133–140 doi:10.1007/s11224-016-0828-4 IF 1.624

Метки: Q2, ToposPro, Vladislav A. Blatov

3 ноября 2016 г.
Knowledge-Based Approaches to H-Bonding Patterns in Heterocycle-1-Carbohydrazoneamides.

Anna V. Vologzhanina, Andrey V. Sokolov, Petr P. Purygin, Pavel N. Zolotarev and Vladislav A. Blatov Knowledge-Based Approaches to H-Bonding Patterns in Heterocycle-1-Carbohydrazoneamides. Crystal Growth & Design, 2016, 16 (11), 6354–6362. doi: 10.1021/acs.cgd.6b00990 IF 3.972

Метки: Andrey V. Sokolov, Pavel N. Zolotarev, Q1, ToposPro, Vladislav A. Blatov

26 октября 2016 г.
Chemical design of heterometallic coordination polymers based on {Cu(Me2mal)2} fragment.

Natalia Vyacheslavovna Gogoleva, Ekaterina N. Zorina-Tikhonova, Artem S. Bogomyakov, Nikolay N. Efimov, Eugeny V. Alexandrov, Elena A. Ugolkova, Mikhail A. Kiskin, Vadim V. Minin, Aleksey A. Sidorov, Vladimir M. Novotortsev, Igor L. Eremenko Chemical design of heterometallic coordination polymers based on {Cu(Me2mal)2} fragment. European Journal of Inorganic Chemistry, 2016, 2017 (3), 547–562. doi: 10.1002/ejic.201601047 IF 2.578

Метки: Eugeny V. Alexandrov, Q2

25 октября 2016 г.
Identification of solid oxygen-containing Na-electrolytes: An assessment based on crystallographic and economic parameters.

Falk Meutzner, Wolfram Münchgesang, Tilmann Leisegang, Robert Schmid, Matthias Zschornak, Mateo Ureña de Vivanco, Alexander P. Shevchenko, Vladislav A. Blatov, Dirk C. Meyer Identification of solid oxygen-containing Na-electrolytes: An assessment based on crystallographic and economic parameters. Crystal Research and Technology, 2016, 52 (1), 1600223. doi: 10.1002/crat.201600223 IF 0.95

Метки: Alexander P. Shevchenko, Q2, ToposPro, Vladislav A. Blatov

Cover Picture: Orthorhombic HP‐REOF (RE =

18 октября 2016 г.
Synthesis, Structures, and Properties of Cadmium(II) and Nickel(II) Coordination Polymers Based on a 4,4′-Biphenyl-Containing Ligand and Aliphatic Carboxylic Acids.

Vladislav A. Blatov, Yan-Qin Zhao, Zeng-Chuan Hao, Guang-Hua Cui Synthesis, Structures, and Properties of Cadmium(II) and Nickel(II) Coordination Polymers Based on a 4,4′-Biphenyl-Containing Ligand and Aliphatic Carboxylic Acids. Zeitschrift für anorganische und allgemeine Chemie, 2016, 20, 1184–1190. doi: 10.1002/zaac.201600210 IF 1.179

Метки: Q3, Vladislav A. Blatov

17 октября 2016 г.
The R₂Pd₃Ge₅ (R = La–Nd, Sm) germanides: synthesis, crystal structure and symmetry reduction.

Pavlo Solokha, Riccardo Freccero, Serena De Negri, Davide M. Proserpio, Adriana Saccone The R₂Pd₃Ge₅ (R = La–Nd, Sm) germanides: synthesis, crystal structure and symmetry reduction. Structural Chemistry, 2016, 27 (6), 1693–1701. doi:10.1007/s11224-016-0812-z IF 1.624

Метки: Davide M. Proserpio, Q2

17 октября 2016 г.
Bergman, Bergman-based and 63-atom nanoclusters in intermetallics.

Akhmetshina T. G., Blatov V. A. Bergman, Bergman-based and 63-atom nanoclusters in intermetallics. Structural Chemistry, 2016, 27 (6), 1685–1692. doi:10.1007/s11224-016-0804-z IF 1.624

Метки: Q2, ToposPro, Vladislav A. Blatov

17 октября 2016 г.
A method for topological analysis of rod packings.

Blatov V. A. A method for topological analysis of rod packings. Structural Chemistry, 2016, 27 (6), 1605–1611. doi:10.1007/s11224-016-0774-1 IF 1.624

Метки: Q2, ToposPro, Vladislav A. Blatov

16 октября 2016 г.
A family of entangled coordination polymers constructed from a flexible bisimidazole ligand and versatile polycarboxylic acids: Syntheses, structures and properties.

Siyu Liu, Yongnian Yan, Mingming Guo, Huadong Guo, Xianmin Guo, Eugeny V. Alexandrov A family of entangled coordination polymers constructed from a flexible bisimidazole ligand and versatile polycarboxylic acids: Syntheses, structures and properties. Inorganica Chimica Acta, 2016, 453, 704–714. doi: 10.1016/j.ica.2016.09.044 IF 2.264

Метки: Eugeny V. Alexandrov, Q2

22 августа 2016 г.
Homo Citans and Carbon Allotropes: For an Ethics of Citation.

Dr. Roald Hoffmann, Dr. Artyom A. Kabanov, Andrey A. Golov, and Prof. Davide M. Proserpio Homo Citans and Carbon Allotropes: For an Ethics of Citation. Angewandte Chemie International Edition, 2016, 55, 10962–10976. doi: 10.1002/anie.201600655 IF 12.257

Метки: Artem A. Kabanov, Davide M. Proserpio, Q1, ToposPro

9 февраля 2016 г.
Searching New Crystalline Substrates for OMBE: Topological and Energetic Aspects of Cleavable Organic Crystals.

Pavel N. Zolotarev, Massimo Moret, Silvia Rizzato, and Davide M. Proserpio Searching New Crystalline Substrates for OMBE: Topological and Energetic Aspects of Cleavable Organic Crystals. Crystal Growth & Design, 2016. doi: 10.1021/acs.cgd.5b01695 IF 3.972

Метки: Davide M. Proserpio, Pavel N. Zolotarev, Q1, ToposPro

7 января 2016 г.
An Unprecedented Densely Self-Catenated Metal−Organic Framework Containing Inclined Catenated Honeycomb-like Units with the Highest Topological Density among 4-Coordinated Nets.

Ju-Meng Hu, Vladislav A. Blatov, Baoyi Yu, Kristof Van Hecke and Guang Hua Cui An Unprecedented Densely Self-Catenated Metal−Organic Framework Containing Inclined Catenated Honeycomb-like Units with the Highest Topological Density among 4-Coordinated Nets. Dalton Transactions, 2016, 45, 2426–2429. doi: 10.1039/C5DT04679C IF 4.099

Метки: Q1, Vladislav A. Blatov

5 января 2016 г.
Synthesis and description of intermolecular interactions in new sulfonamide derivatives of tranexamic acid.

Muhammad Ashfaq, Muhammad Nadeem Arshad, Muhammad Danish, Abdullah M. Asiri, Sadia Khatoon, Ghulam Mustafa, Pavel N. Zolotarev, Rabia Ayub Butt, Onur Ṣahin Synthesis and Studies on Inter- and Intramolecular Interactions in New Sulfonamide Derivatives of Tranexamic Acid. Journal of Molecular Structure, 2016, 1103, 271-280. doi:10.1016/j.molstruc.2015.09.022 IF 2.011

Метки: Pavel N. Zolotarev, Q3

9 ноября 2015 г.
On the Way to New Possible Na-Ion Conductors: The Voronoi–Dirichlet Approach, Data Mining and Symmetry Considerations in Ternary Na Oxides.

Falk Meutzner, Dr. Wolfram Münchgesang, Natalya A. Kabanova, Dr. Matthias Zschornak, Dr. Tilmann Leisegang, Prof. Vladislav A. Blatov, Prof. Dirk C. Meyer On the Way to New Possible Na-Ion Conductors: The Voronoi–Dirichlet Approach, Data Mining and Symmetry Considerations in Ternary Na Oxides. Chemistry — A European Journal, 2015, 21 (46), 16601–16608. doi:10.1002/chem.201501975 IF 5.160

Метки: Natalya A. Kabanova, Q1, ToposPro, Vladislav A. Blatov

175 spine minimum. full size. Editor: Kathy/Gloria JEM: Diane
RTP: Rebecca Horseman

27 октября 2015 г.
Topological Motifs in Cyanometallates: From Building Units to Three-Periodic Frameworks.

Eugeny V. Alexandrov, Alexander V. Virovets, Vladislav A. Blatov, and Eugenia V. Peresypkina Topological Motifs in Cyanometallates: From Building Units to Three-Periodic Frameworks. Chemical Reviews, 2015, 115 (22), 12286–12319 doi: 10.1021/acs.chemrev.5b00320 IF 46

Метки: Eugeny V. Alexandrov, Q1, ToposPro, Vladislav A. Blatov

1 октября 2015 г.
Diorganotin (IV) complexes with 2-furancarboxylic acid hydrazone derivative of benzoylacetone: Synthesis, X-ray structure, antibacterial activity, DNA cleavage and molecular docking.

Tahereh Sedaghat, Yahya Ebrahimi, Lucia Carlucci, Davide M. Proserpio, Valiollah Nobakht, Hossein Motamedi, Mohammad Reza Dayer. Diorganotin (IV) complexes with 2-furancarboxylic acid hydrazone derivative of benzoylacetone: Synthesis, X-ray structure, antibacterial activity, DNA cleavage and molecular docking. Journal of Organometallic Chemistry, 2015, 794 223-230. doi:10.1016/j.jorganchem.2015.06.034 IF 2.173

Метки: Davide M. Proserpio, Q2

11 июня 2015 г.
A Collection of Topological Types of Nanoclusters and Its Application to Icosahedron-Based Intermetallics.

Arina A. Pankova, Tatiana G. Akhmetshina, Vladislav A. Blatov, and Davide M. Proserpio. A Collection of Topological Types of Nanoclusters and Its Application to Icosahedron-Based Intermetallics. Inorganic Chemistry, 2015, 54 (13), 6616–6630. doi:10.1021/acs.inorgchem.5b00960 IF 4.700

Метки: Davide M. Proserpio, Q1, ToposPro, Vladislav A. Blatov

1 апреля 2015 г.
Моделирование процессов самоорганизации в кристаллообразующих системах: темплатированные нанокластеры прекурсоры Т48 и самосборка кристаллических структур цеолитов 15Crown5, NaFAU, 18Crown6, NaEMT и Ca,BaTSC..

Г. Д. Илюшин, В.А. Блатов. Моделирование процессов самоорганизации в кристаллообразующих системах: темплатированные нанокластеры прекурсоры Т48 и самосборка кристаллических структур цеолитов 15Crown5, NaFAU, 18Crown6, NaEMT и Ca,BaTSC. Журнал неорганической химии, 2015, Том. 60, No. 4, с. 529–543. doi: 10.1134/S0036023615040063 IF 0.649

Метки: Q3, Vladislav A. Blatov

19 марта 2015 г.
Three Silver(I) Coordination Polymers Constructed from Flexible Bis(benzimidazole) and Carboxylates Ligands.

Xiao Xiao Wang, Yong Guang Liu, Kristof Van Hecke, Andrey Goltsev and Guang Hua Cui. Three Silver(I) Coordination Polymers Constructed from Flexible Bis(benzimidazole) and Carboxylates Ligands. Zeitschrift für anorganische und allgemeine Chemie, 2015, 641, (5), 903–910. doi: 10.1002/zaac.201400597 IF 1.179

Метки: Q3

23 февраля 2015 г.
New knowledge and tools for crystal design: local coordination versus overall network topology and much more.

Eugeny V. Alexandrov, Alexander P. Shevchenko, Abdullah A. Asiri and Vladislav A. Blatov.New knowledge and tools for crystal design: local coordination versus overall network topology and much more. CrystEngComm, 2015, 17 (15), 2913-2924. doi: 10.1039/C4CE02418D IF 3.382

Метки: Alexander P. Shevchenko, Eugeny V. Alexandrov, Q1, ToposPro, Vladislav A. Blatov

10 февраля 2015 г.
Vacancy Ordering as a Driving Factor for Structural Changes in Ternary Germanides: The New R₂Zn_1–xGe₆ Series of Polar Intermetallics (R = Rare-Earth Metal).

Pavlo Solokha, Serena De Negri, Davide M. Proserpio, Vladislav A. Blatov, and Adriana Saccone. Vacancy Ordering as a Driving Factor for Structural Changes in Ternary Germanides: The New R₂Zn_1–xGe₆ Series of Polar Intermetallics (R = Rare-Earth Metal). Inorganic Chemistry, 2015, 54 (5), 2411–2424. doi: 10.1021/ic5030313 IF 4.700

Метки: Davide M. Proserpio, Q1, Vladislav A. Blatov