| All-boron aromatic clusters as potential new inorganic ligands and building blocks in chemistry AN Alexandrova, AI Boldyrev, HJ Zhai, LS Wang Coordination Chemistry Reviews 250 (21-22), 2811-2866, 2006 | 707 | 2006 |
| Hepta‐and octacoordinate boron in molecular wheels of eight‐and nine‐atom boron clusters: Observation and confirmation HJ Zhai, AN Alexandrova, KA Birch, AI Boldyrev, LS Wang Angewandte Chemie International Edition 42 (48), 6004-6008, 2003 | 558 | 2003 |
| Structure of the clusters via ab initio genetic algorithm and photoelectron spectroscopy AN Alexandrova, AI Boldyrev, YJ Fu, X Yang, XB Wang, LS Wang The Journal of chemical physics 121 (12), 5709-5719, 2004 | 302 | 2004 |
| Electronic structure and chemical bonding of and by photoelectron spectroscopy and ab initio calculations HJ Zhai, LS Wang, AN Alexandrova, AI Boldyrev The Journal of Chemical Physics 117 (17), 7917-7924, 2002 | 273 | 2002 |
| Search for the Lin0/+1/-1 (n = 5−7) Lowest-Energy Structures Using the ab Initio Gradient Embedded Genetic Algorithm (GEGA). Elucidation of the Chemical … AN Alexandrova, AI Boldyrev Journal of chemical theory and computation 1 (4), 566-580, 2005 | 249 | 2005 |
| Structure and Bonding in B6- and B6: Planarity and Antiaromaticity AN Alexandrova, AI Boldyrev, HJ Zhai, LS Wang, E Steiner, PW Fowler The Journal of Physical Chemistry A 107 (9), 1359-1369, 2003 | 249 | 2003 |
| Electronic Structure, Isomerism, and Chemical Bonding in B7- and B7 AN Alexandrova, AI Boldyrev, HJ Zhai, LS Wang The Journal of Physical Chemistry A 108 (16), 3509-3517, 2004 | 244 | 2004 |
| Photoelectron Spectroscopy and ab Initio Study of B3- and B4- Anions and Their Neutrals HJ Zhai, LS Wang, AN Alexandrova, AI Boldyrev, VG Zakrzewski The Journal of Physical Chemistry A 107 (44), 9319-9328, 2003 | 236 | 2003 |
| σ-Aromaticity and σ-antiaromaticity in alkali metal and alkaline earth metal small clusters AN Alexandrova, AI Boldyrev The Journal of Physical Chemistry A 107 (4), 554-560, 2003 | 236 | 2003 |
| Ensembles of metastable states govern heterogeneous catalysis on dynamic interfaces Z Zhang, B Zandkarimi, AN Alexandrova Accounts of chemical research 53 (2), 447-458, 2020 | 199 | 2020 |
| Fluxionality of catalytic clusters: when it matters and how to address it H Zhai, AN Alexandrova ACS Catalysis 7 (3), 1905-1911, 2017 | 192 | 2017 |
| Molecular Wheel B82- as a New Inorganic Ligand. Photoelectron Spectroscopy and ab Initio Characterization of LiB8- AN Alexandrova, HJ Zhai, LS Wang, AI Boldyrev Inorganic chemistry 43 (12), 3552-3554, 2004 | 178 | 2004 |
| Mysteries of metals in metalloenzymes CE Valdez, QA Smith, MR Nechay, AN Alexandrova Accounts of chemical research 47 (10), 3110-3117, 2014 | 170 | 2014 |
| The role of alkali metal cations and platinum-surface hydroxyl in the alkaline hydrogen evolution reaction AH Shah, Z Zhang, Z Huang, S Wang, G Zhong, C Wan, AN Alexandrova, ... Nature Catalysis 5 (10), 923-933, 2022 | 150 | 2022 |
| Ethylene Dehydrogenation on Pt4,7,8 Clusters on Al2O3: Strong Cluster Size Dependence Linked to Preferred Catalyst Morphologies ET Baxter, MA Ha, AC Cass, AN Alexandrova, SL Anderson Acs Catalysis 7 (5), 3322-3335, 2017 | 147 | 2017 |
| Ensemble-average representation of Pt clusters in conditions of catalysis accessed through GPU accelerated deep neural network fitting global optimization H Zhai, AN Alexandrova Journal of chemical theory and computation 12 (12), 6213-6226, 2016 | 142 | 2016 |
| Why urea eliminates ammonia rather than hydrolyzes in aqueous solution AN Alexandrova, WL Jorgensen The Journal of Physical Chemistry B 111 (4), 720-730, 2007 | 138 | 2007 |
| Boron Switch for Selectivity of Catalytic Dehydrogenation on Size-Selected Pt Clusters on Al2O3 MA Ha, ET Baxter, AC Cass, SL Anderson, AN Alexandrova Journal of the American Chemical Society 139 (33), 11568-11575, 2017 | 124 | 2017 |
| Building structures atom by atom via electron beam manipulation O Dyck, S Kim, E Jimenez‐Izal, AN Alexandrova, SV Kalinin, S Jesse Small 14 (38), 1801771, 2018 | 121 | 2018 |
| Amorphous nickel hydroxide shell tailors local chemical environment on platinum surface for alkaline hydrogen evolution reaction C Wan, Z Zhang, J Dong, M Xu, H Pu, D Baumann, Z Lin, S Wang, ... Nature Materials 22 (8), 1022-1029, 2023 | 118 | 2023 |