| Quantum-mechanical interpretation of the exchange-correlation potential of kohn-sham density-functional theory MK Harbola, V Sahni Physical review letters 62 (5), 489, 1989 | 284 | 1989 |
| Aspects of the softness and hardness concepts of density‐functional theory MK Harbola, PK Chattaraj, RG Parr Israel journal of chemistry 31 (4), 395-402, 1991 | 164 | 1991 |
| Magic numbers for metallic clusters and the principle of maximum hardness. MK Harbola Proceedings of the National Academy of Sciences 89 (3), 1036-1039, 1992 | 110 | 1992 |
| Atomic structure in the Pauli-correlated approximation V Sahni, Y Li, MK Harbola Physical Review A 45 (3), 1434, 1992 | 86 | 1992 |
| Quantum‐Mechanical interpretation of the local many‐body potential of density‐functional theory V Sahni, MK Harbola International Journal of Quantum Chemistry 38 (S24), 569-584, 1990 | 81 | 1990 |
| Analysis of the local-density approximation of density-functional theory V Sahni, KP Bohnen, MK Harbola Physical Review A 37 (6), 1895, 1988 | 64 | 1988 |
| Hydrodynamic approach to time-dependent density functional theory; Response properties of metal clusters A Banerjee, MK Harbola The Journal of Chemical Physics 113 (14), 5614-5623, 2000 | 60 | 2000 |
| Structure of the Fermi hole at surfaces MK Harbola, V Sahni Physical Review B 37 (2), 745, 1988 | 59 | 1988 |
| Relationship between the highest occupied Kohn-Sham orbital eigenvalue and ionization energy MK Harbola Physical Review B 60 (7), 4545, 1999 | 56 | 1999 |
| Quantum-mechanical origin of the asymptotic effective potential at metal surfaces MK Harbola, V Sahni Physical Review B 39 (14), 10437, 1989 | 48 | 1989 |
| Theories of electronic structure in the Pauli-correlated approximation MK Harbola, V Sahni Journal of chemical education 70 (11), 920, 1993 | 47 | 1993 |
| Ground-state energies and highest occupied eigenvalues of atoms in exchange-only density-functional theory Y Li, MK Harbola, JB Krieger, V Sahni Physical Review A 40 (10), 6084, 1989 | 46 | 1989 |
| Density-functional-theory calculations of the total energies, ionization potentials, and optical response properties with the van Leeuwen–Baerends potential A Banerjee, MK Harbola Physical Review A 60 (5), 3599, 1999 | 44 | 1999 |
| Exploring foundations of time-independent density functional theory for excited states P Samal, MK Harbola Journal of Physics B: Atomic, Molecular and Optical Physics 39 (20), 4065, 2006 | 43 | 2006 |
| Exchange-correlation potentials in ground-and excited-state Kohn-Sham theory MK Harbola Physical Review A 69 (4), 042512, 2004 | 42 | 2004 |
| Density-to-potential map in time-independent excited-state density-functional theory P Samal, MK Harbola, A Holas Chemical physics letters 419 (1-3), 217-222, 2006 | 38 | 2006 |
| Differential virial theorem for the fractional electron number: Derivative discontinuity of the Kohn-Sham exchange-correlation potential MK Harbola Physical Review A 57 (6), 4253, 1998 | 37 | 1998 |
| Stable negative ions within a local exchange formalism KD Sen, MK Harbola Chemical physics letters 178 (4), 347-350, 1991 | 35 | 1991 |
| Force field and potential due to the Fermi-Coulomb hole charge for nonspherical-density atoms M Slamet, V Sahni, MK Harbola Physical Review A 49 (2), 809, 1994 | 34 | 1994 |
| Local exchange-correlation potential from the force field of the Fermi-Coulomb hole charge for non-symmetric systems MK Harbola, M Slamet, V Sahni Physics Letters A 157 (1), 60-64, 1991 | 34 | 1991 |
