| A possible route toward expert systems in supramolecular chemistry: 2-periodic H-bond patterns in molecular crystals PN Zolotarev, MN Arshad, AM Asiri, ZM Al-Amshany, VA Blatov Crystal growth & design 14 (4), 1938-1949, 2014 | 49 | 2014 |
| Li(Ni,Co,Al)O2 Cathode Delithiation: A Combination of Topological Analysis, Density Functional Theory, Neutron Diffraction, and Machine Learning Techniques RA Eremin, PN Zolotarev, OY Ivanshina, IA Bobrikov The Journal of Physical Chemistry C 121 (51), 28293-28305, 2017 | 48 | 2017 |
| A 3D Coordination Network Built from CuII4Cl3(H2O)2 Linear Clusters and Tetrapyridyl Tetrahedral Silane Ligands: Reversible Iodine Uptake and Friedel … MS Deshmukh, A Chaudhary, PN Zolotarev, R Boomishankar Inorganic chemistry 56 (19), 11762-11767, 2017 | 23 | 2017 |
| Searching new crystalline substrates for OMBE: topological and energetic aspects of cleavable organic crystals PN Zolotarev, M Moret, S Rizzato, DM Proserpio Crystal Growth & Design 16 (3), 1572-1582, 2016 | 21 | 2016 |
| Knowledge-based approaches to H-bonding patterns in heterocycle-1-carbohydrazoneamides AV Vologzhanina, AV Sokolov, PP Purygin, PN Zolotarev, VA Blatov Crystal Growth & Design 16 (11), 6354-6362, 2016 | 17 | 2016 |
| Ionic Transport in Doped Solid Electrolytes by Means of DFT Modeling and ML Approaches: A Case Study of Ti-Doped KFeO2 RA Eremin, PN Zolotarev, AA Golov, NA Nekrasova, T Leisegang The Journal of Physical Chemistry C 123 (49), 29533-29542, 2019 | 14 | 2019 |
| Supramolecular architectures of Mn (NCS) 2 complexes with N'-(1-(pyridin-4-yl) ethylidene) picolinohydrazide and N'-(phenyl (pyridin-4-yl) methylene) isonicotinohydrazide G Mahmoudi, M Kubicki, D Choquesillo-Lazarte, B Miroslaw, ... Polyhedron 190, 114776, 2020 | 10 | 2020 |
| On the influence of solvent properties on the structural characteristics of molecular crystal polymorphs PN Zolotarev, NA Nekrasova Crystal Growth & Design 20 (11), 7152-7162, 2020 | 10 | 2020 |
| Hybrid dft/data-driven approach for searching for new quasicrystal approximants in sc-x (x= rh, pd, ir, pt) systems RA Eremin, IS Humonen, PN Zolotarev, IV Medrish, LE Zhukov, ... Crystal Growth & Design 22 (7), 4570-4581, 2022 | 5 | 2022 |
| Topological analysis of procrystal electron densities as a tool for computational modeling of solid electrolytes: A case study of known and promising potassium conductors PN Zolotarev, AA Golov, NA Nekrasova, RA Eremin AIP Conference Proceedings 2163 (1), 2019 | 5 | 2019 |
| Delithiated states of layered cathode materials: doping and dispersion interaction effects on the structure R Eremin, P Zolotarev, I Bobrikov EPJ Web of Conferences 177, 02001, 2018 | 5 | 2018 |
| Synthesis and description of intermolecular interactions in new sulfonamide derivatives of tranexamic acid M Ashfaq, MN Arshad, M Danish, AM Asiri, S Khatoon, G Mustafa, ... Journal of Molecular Structure 1103, 271-280, 2016 | 5 | 2016 |
| Topology-based description of the NCA cathode configurational space and an approach of its effective reduction P Zolotarev, R Eremin EPJ Web of Conferences 177, 02005, 2018 | 4 | 2018 |
| Relationships between Changes in Guest Ion Properties and in the Host Framework Topology in Ionic Coordination Polymers PN Zolotarev Crystal Growth & Design 21 (9), 4959-4970, 2021 | 3 | 2021 |
| A machine learning approach for predicting formation enthalpy: A case study of Mackay-type approximants of icosahedral quasicrystals R Eremin, P Zolotarev, T Leisegang, P Solokha AIP Conference Proceedings 2163 (1), 2019 | 3 | 2019 |
| Topological study of diverse hydrogen-bonded patterns found in a system of a nickel (II) complex and the sulfate anion MA Harvey, S Suarez, PN Zolotarev, DM Proserpio, R Baggio Acta Crystallographica Section C: Structural Chemistry 74 (3), 351-359, 2018 | 2 | 2018 |
| Photocatalytic degradation of methylene blue using sunlight-powered coordination polymers constructed from a tetracarboxylate linker AC Oladipo, AD Aderibigbe, VT Olayemi, PA Ajibade, HS Clayton, ... Journal of Photochemistry and Photobiology A: Chemistry 448, 115331, 2024 | 1 | 2024 |
| A combined DFT/topological analysis approach for modeling disordered solid electrolytes P Zolotarev, N Nekrasova, A Golov, R Eremin EPJ Web of Conferences 201, 02005, 2019 | 1 | 2019 |
| A redox active rod coordination polymer from tetrakis (4-carboxylic acid biphenyl) tetrathiafulvalene N Zigon, F Solano, P Auban-Senzier, S Grolleau, T Devic, PN Zolotarev, ... Dalton Transactions, 2024 | | 2024 |
| Comparative analysis of DFT-vdW vs. Coulomb energies for configurational space of layered cathode material at different delithiation levels P Zolotarev, R Eremin EPJ Web of Conferences 201, 02004, 2019 | | 2019 |
Roman A. EreminArtificial Intelligence Research Institute, MoscowVerified email at airi.net
