| Unconventional superconductivity in magic-angle graphene superlattices Y Cao, V Fatemi, S Fang, K Watanabe, T Taniguchi, E Kaxiras, ... Nature 556 (7699), 43-50, 2018 | 5775 | 2018 |
| Correlated insulator behaviour at half-filling in magic-angle graphene superlattices Y Cao, V Fatemi, A Demir, S Fang, SL Tomarken, JY Luo, ... Nature 556 (7699), 80-84, 2018 | 3353 | 2018 |
| Optimized pseudopotentials AM Rappe, KM Rabe, E Kaxiras, JD Joannopoulos Physical Review B 41 (2), 1227, 1990 | 2569 | 1990 |
| Surfactants in epitaxial growth M Copel, MC Reuter, E Kaxiras, RM Tromp Physical review letters 63 (6), 632, 1989 | 1401 | 1989 |
| Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment M Elstner, P Hobza, T Frauenheim, S Suhai, E Kaxiras The Journal of Chemical Physics 114 (12), 5149-5155, 2001 | 1196 | 2001 |
| Concurrent coupling of length scales: methodology and application JQ Broughton, FF Abraham, N Bernstein, E Kaxiras Physical review B 60 (4), 2391, 1999 | 873 | 1999 |
| Atomic and electronic structure of solids E Kaxiras Atomic and Electronic Structure of Solids, 696, 2003 | 698 | 2003 |
| A QM/MM implementation of the self-consistent charge density functional tight binding (SCC-DFTB) method Q Cui, M Elstner, E Kaxiras, T Frauenheim, M Karplus The Journal of Physical Chemistry B 105 (2), 569-585, 2001 | 673 | 2001 |
| Graphene/MoS2 Hybrid Technology for Large-Scale Two-Dimensional Electronics L Yu, YH Lee, X Ling, EJG Santos, YC Shin, Y Lin, M Dubey, E Kaxiras, ... Nano letters 14 (6), 3055-3063, 2014 | 626 | 2014 |
| Interatomic potential for silicon defects and disordered phases JF Justo, MZ Bazant, E Kaxiras, VV Bulatov, S Yip Physical review B 58 (5), 2539, 1998 | 570 | 1998 |
| Environment-dependent interatomic potential for bulk silicon MZ Bazant, E Kaxiras, JF Justo Physical Review B 56 (14), 8542, 1997 | 552 | 1997 |
| Properties of nitrogen-vacancy centers in diamond: the group theoretic approach JR Maze, A Gali, E Togan, Y Chu, A Trifonov, E Kaxiras, MD Lukin New Journal of Physics 13 (2), 025025, 2011 | 546 | 2011 |
| Graphene nanoflakes with large spin WL Wang, S Meng, E Kaxiras Nano letters 8 (1), 241-245, 2008 | 488 | 2008 |
| Atomic and electronic reconstruction at the van der Waals interface in twisted bilayer graphene H Yoo, R Engelke, S Carr, S Fang, K Zhang, P Cazeaux, SH Sung, ... Nature materials 18 (5), 448-453, 2019 | 474 | 2019 |
| Spanning the continuum to quantum length scales in a dynamic simulation of brittle fracture FF Abraham, JQ Broughton, N Bernstein, E Kaxiras Europhysics letters 44 (6), 783, 1998 | 466 | 1998 |
| Multiphysics simulations: Challenges and opportunities DE Keyes, LC McInnes, C Woodward, W Gropp, E Myra, M Pernice, J Bell, ... The International Journal of High Performance Computing Applications 27 (1 …, 2013 | 435 | 2013 |
| Spanning the length scales in dynamic simulation FF Abraham, JQ Broughton, N Bernstein, E Kaxiras Computers in Physics 12 (6), 538-546, 1998 | 401 | 1998 |
| Ab initio supercell calculations on nitrogen-vacancy center in diamond: Electronic structure and hyperfine tensors A Gali, M Fyta, E Kaxiras Physical Review B 77 (15), 155206, 2008 | 400 | 2008 |
| MoS2 Field-Effect Transistor with Sub-10 nm Channel Length A Nourbakhsh, A Zubair, RN Sajjad, A Tavakkoli KG, W Chen, S Fang, ... Nano letters 16 (12), 7798-7806, 2016 | 396 | 2016 |
| Adsorption and diffusion of lithium on layered silicon for Li-ion storage GA Tritsaris, E Kaxiras, S Meng, E Wang Nano letters 13 (5), 2258-2263, 2013 | 391 | 2013 |
