| Adsorption of ethane, ethylene, propane, and propylene on a magnesium-based metal–organic framework Z Bao, S Alnemrat, L Yu, I Vasiliev, Q Ren, X Lu, S Deng Langmuir 27 (22), 13554-13562, 2011 | 336 | 2011 |
| Ab initio Calculations for the Polarizabilities of Small Semiconductor Clusters I Vasiliev, S Öğüt, JR Chelikowsky Physical review letters 78 (25), 4805, 1997 | 270 | 1997 |
| Ab Initio Absorption Spectra and Optical Gaps in Nanocrystalline Silicon I Vasiliev, S Öğüt, JR Chelikowsky Physical Review Letters 86 (9), 1813, 2001 | 264 | 2001 |
| Surface oxidation effects on the optical properties of silicon nanocrystals I Vasiliev, JR Chelikowsky, RM Martin Physical Review B 65 (12), 121302, 2002 | 253 | 2002 |
| Ab Initio Excitation Spectra and Collective Electronic Response in Atoms and Clusters I Vasiliev, S Öğüt, JR Chelikowsky Physical review letters 82 (9), 1919, 1999 | 239 | 1999 |
| First-principles density-functional calculations for optical spectra of clusters and nanocrystals I Vasiliev, S Öğüt, JR Chelikowsky Physical Review B 65 (11), 115416, 2002 | 225 | 2002 |
| Theoretical study of the surface energy, stress, and lattice contraction of silver nanoparticles B Medasani, YH Park, I Vasiliev Physical Review B 75 (23), 235436, 2007 | 198 | 2007 |
| Time-dependent density-functional calculations for the optical spectra of molecules, clusters, and nanocrystals JR Chelikowsky, L Kronik, I Vasiliev Journal of Physics: Condensed Matter 15 (35), R1517, 2003 | 128 | 2003 |
| Kinetic separation of carbon dioxide and methane on a copper metal–organic framework Z Bao, S Alnemrat, L Yu, I Vasiliev, Q Ren, X Lu, S Deng Journal of colloid and interface science 357 (2), 504-509, 2011 | 123 | 2011 |
| Ab initio study of K adsorption on graphene and carbon nanotubes: Role of long-range ionic forces A Lugo-Solis, I Vasiliev Physical Review B 76 (23), 235431, 2007 | 121 | 2007 |
| Ab initio absorption spectra of gallium arsenide clusters I Vasiliev, S Öğüt, JR Chelikowsky Physical Review B 60 (12), R8477, 1999 | 85 | 1999 |
| Ab initio absorption spectra of clusters MD Deshpande, DG Kanhere, I Vasiliev, RM Martin Physical Review B 68 (3), 035428, 2003 | 83 | 2003 |
| Ab initio structures and polarizabilities of sodium clusters L Kronik, I Vasiliev, M Jain, JR Chelikowsky The Journal of Chemical Physics 115 (9), 4322-4332, 2001 | 80 | 2001 |
| Ab initio study of carboxylated graphene N Al-Aqtash, I Vasiliev The Journal of Physical Chemistry C 113 (30), 12970-12975, 2009 | 73 | 2009 |
| Ab initio calculations for structure and temperature effects on the polarizabilities of clusters L Kronik, I Vasiliev, JR Chelikowsky Physical Review B 62 (15), 9992, 2000 | 72 | 2000 |
| Ab initio study of boron-and nitrogen-doped graphene and carbon nanotubes functionalized with carboxyl groups N Al-Aqtash, I Vasiliev The Journal of Physical Chemistry C 115 (38), 18500-18510, 2011 | 68 | 2011 |
| Computational study of the surface properties of aluminum nanoparticles B Medasani, I Vasiliev Surface science 603 (13), 2042-2046, 2009 | 68 | 2009 |
| Ab initio study of the interactions between boron and nitrogen dopants in graphene N Al-Aqtash, KM Al-Tarawneh, T Tawalbeh, I Vasiliev Journal of Applied Physics 112 (3), 2012 | 55 | 2012 |
| Parallel implementation of time-dependent density functional theory WR Burdick, Y Saad, L Kronik, I Vasiliev, M Jain, JR Chelikowsky Computer Physics Communications 156 (1), 22-42, 2003 | 53 | 2003 |
| Electronic structure methods for predicting the properties of materials: Grids in space JR Chelikowsky, Y Saad, S Öğüt, I Vasiliev, A Stathopoulos physica status solidi (b) 217 (1), 173-195, 2000 | 42 | 2000 |
