Mel Levy - Publications

Affiliations: 
Tulane University, New Orleans, LA, United States 
Area:
theoretical chemistry
Website:
http://www.iaqms.org/members/levy.php

144 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2022 Kaplan AD, Levy M, Perdew JP. The Predictive Power of Exact Constraints and Appropriate Norms in Density Functional Theory. Annual Review of Physical Chemistry. PMID 36696591 DOI: 10.1146/annurev-physchem-062422-013259  0.339
2022 Teale AM, Helgaker T, Savin A, Adamo C, Aradi B, Arbuznikov AV, Ayers PW, Baerends EJ, Barone V, Calaminici P, Cancès E, Carter EA, Chattaraj PK, Chermette H, Ciofini I, ... ... Levy M, et al. DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science. Physical Chemistry Chemical Physics : Pccp. PMID 36269074 DOI: 10.1039/d2cp02827a  0.73
2020 Kaplan AD, Santra B, Bhattarai P, Wagle K, Chowdhury STUR, Bhetwal P, Yu J, Tang H, Burke K, Levy M, Perdew JP. Simple hydrogenic estimates for the exchange and correlation energies of atoms and atomic ions, with implications for density functional theory. The Journal of Chemical Physics. 153: 074114. PMID 32828077 DOI: 10.1063/5.0017805  0.375
2018 Levy M. On the best partitioning of the density functional energy. Journal of Molecular Modeling. 24: 311. PMID 30306275 DOI: 10.1007/S00894-018-3842-1  0.411
2018 Sharpe DJ, Levy M, Tozer DJ. Approximating the shifted Hartree-exchange-correlation potential in direct energy Kohn-Sham theory. Journal of Chemical Theory and Computation. PMID 29298061 DOI: 10.1021/Acs.Jctc.7B01060  0.359
2018 Zahariev F, Gordon MS, Levy M. Nodal variational principle for excited states Physical Review A. 98. DOI: 10.1103/Physreva.98.012144  0.694
2018 Ayers PW, Levy M, Nagy Á. Time-independent density functional theory for degenerate excited states of Coulomb systems Theoretical Chemistry Accounts. 137: 152. DOI: 10.1007/S00214-018-2352-7  0.548
2017 Vuckovic S, Levy M, Gori-Giorgi P. Augmented potential, energy densities, and virial relations in the weak- and strong-interaction limits of DFT. The Journal of Chemical Physics. 147: 214107. PMID 29221411 DOI: 10.1063/1.4997311  0.458
2016 Zahariev F, Levy M. Properties of Augmented Kohn-Sham Potential for Energy as Simple Sum of Orbital Energies. The Journal of Physical Chemistry. A. PMID 28004931 DOI: 10.1021/Acs.Jpca.6B10952  0.703
2016 Levy M, Zahariev F. On augmented Kohn–Sham potential for energy as a simple sum of orbital energies Molecular Physics. 1-3. DOI: 10.1080/00268976.2016.1153743  0.705
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2016 Levy M. Mathematical thoughts in DFT International Journal of Quantum Chemistry. 116: 802-804. DOI: 10.1002/qua.25133  0.327
2015 Ayers PW, Levy M, Nagy Á. Communication: Kohn-Sham theory for excited states of Coulomb systems. The Journal of Chemical Physics. 143: 191101. PMID 26590518 DOI: 10.1063/1.4934963  0.536
2014 Levy M, Zahariev F. Ground-state energy as a simple sum of orbital energies in Kohn-Sham theory: a shift in perspective through a shift in potential. Physical Review Letters. 113: 113002. PMID 25259974 DOI: 10.1103/Physrevlett.113.113002  0.72
2014 Levy M, Anderson JS, Zadeh FH, Ayers PW. Kinetic and electron-electron energies for convex sums of ground state densities with degeneracies and fractional electron number. The Journal of Chemical Physics. 140: 18A538. PMID 24832346 DOI: 10.1063/1.4871734  0.559
2014 Ayers PW, Levy M. Tight constraints on the exchange-correlation potentials of degenerate states. The Journal of Chemical Physics. 140: 18A537. PMID 24832345 DOI: 10.1063/1.4871732  0.507
2012 Ayers PW, Levy M, Nagy A. Time-independent density-functional theory for excited states of Coulomb systems Physical Review a - Atomic, Molecular, and Optical Physics. 85. DOI: 10.1103/Physreva.85.042518  0.483
2009 Bulat FA, Levy M, Politzer P. Average local ionization energies in the Hartree-Fock and Kohn-Sham theories. The Journal of Physical Chemistry. A. 113: 1384-9. PMID 19170562 DOI: 10.1021/Jp809406P  0.388
2009 Valone SM, Levy M. Stretched hydrogen molecule from a constrained-search density-functional perspective Physical Review a - Atomic, Molecular, and Optical Physics. 80. DOI: 10.1103/Physreva.80.042501  0.694
2009 Ayers PW, Levy M. Time-independent (static) density-functional theories for pure excited states: Extensions and unification Physical Review a - Atomic, Molecular, and Optical Physics. 80. DOI: 10.1103/Physreva.80.012508  0.54
2009 Levy M, Ayers PW. Kinetic energy from a single Kohn-Sham orbital Physical Review a - Atomic, Molecular, and Optical Physics. 79. DOI: 10.1103/Physreva.79.064504  0.551
2009 Levy M. Asymptotic coordinate scaling bound for exchange-correlation energy in density-functional theory International Journal of Quantum Chemistry. 36: 617-619. DOI: 10.1002/Qua.560360864  0.42
2009 Levy M, Perdew JP. Properties of the exact universal density and one-matrix functionals International Journal of Quantum Chemistry. 28: 743-744. DOI: 10.1002/Qua.560280870  0.318
2008 Görling A, Hesselmann A, Jones M, Levy M. Relation between exchange-only optimized potential and Kohn-Sham methods with finite basis sets, and effect of linearly dependent products of orbital basis functions. The Journal of Chemical Physics. 128: 104104. PMID 18345874 DOI: 10.1063/1.2826366  0.429
2006 Ayers PW, Golden S, Levy M. Generalizations of the Hohenberg-Kohn theorem: I. Legendre transform constructions of variational principles for density matrices and electron distribution functions. The Journal of Chemical Physics. 124: 054101. PMID 16468845 DOI: 10.1063/1.2006087  0.526
2005 Ayers PW, Levy M. Using the Kohn-Sham formalism in pair density-functional theories Chemical Physics Letters. 415: 211-216. DOI: 10.1016/J.Cplett.2005.08.059  0.588
2003 Ivanov S, Levy M. Connections between ground-state energies from optimized-effective potential exchange-only and Hartree-Fock methods Journal of Chemical Physics. 119: 7087-7093. DOI: 10.1063/1.1602693  0.42
2002 Ivanov S, Levy M. Accurate correlation potentials from integral formulation of density functional perturbation theory Journal of Chemical Physics. 116: 6924-6929. DOI: 10.1063/1.1453952  0.388
2001 Nagy A, Levy M. Variational density-functional theory for degenerate excited states Physical Review a. Atomic, Molecular, and Optical Physics. 63: 525021-525026. DOI: 10.1103/Physreva.63.052502  0.361
2001 Levy M, Ziesche P. The pair density functional of the kinetic energy and its simple scaling property Journal of Chemical Physics. 115: 9110-9112. DOI: 10.1063/1.1413976  0.402
2001 Ayers PW, Levy M. Sum rules for exchange and correlation potentials Journal of Chemical Physics. 115: 4438-4443. DOI: 10.1063/1.1379333  0.513
2000 Ayers PW, Levy M. Perspective on "Density functional approach to the frontier-electron theory of chemical reactivity" Theoretical Chemistry Accounts. 103: 353-360. DOI: 10.1007/S002149900093  0.545
1999 Levy M, Nagy A. Variational Density-Functional Theory for an Individual Excited State Physical Review Letters. 83: 4361-4364. DOI: 10.1103/Physrevlett.83.4361  0.36
1999 Seidl M, Perdew JP, Levy M. Strictly correlated electrons in density-functional theory Physical Review a - Atomic, Molecular, and Optical Physics. 59: 51-54. DOI: 10.1103/Physreva.59.51  0.42
1999 Ivanov S, Burke K, Levy M. Exact high-density limit of correlation potential for two-electron density Journal of Chemical Physics. 110: 10262-10268. DOI: 10.1063/1.478959  0.351
1999 Ivanov S, Levy M. Adiabatic integration formula for the correlation energy functional of the Hartree-Fock density Theoretical Chemistry Accounts. 103: 117-123. DOI: 10.1007/S002140050522  0.449
1998 Ivanov S, Lopez-Boada R, Görling A, Levy M. Closed-form expression relating the second-order component of the density functional theory correlation energy to its functional derivative Journal of Chemical Physics. 109: 6280-6286. DOI: 10.1063/1.477269  0.366
1998 Ivanov S, Levy M. Connections between high-density scaling limits of DFT correlation energies and second-order Z-1 quantum chemistry correlation energy Journal of Physical Chemistry A. 102: 3151-3156. DOI: 10.1021/Jp9731415  0.377
1998 Ivanov S, Levy M. Second-Order Relations Involving Correlation Energy and its Functional Derivative Advances in Quantum Chemistry. 33: 11-29. DOI: 10.1016/S0065-3276(08)60427-X  0.387
1998 Nagy A, Levy M. Tests for new ionization formula in density functional theory Chemical Physics Letters. 296: 313-315. DOI: 10.1016/S0009-2614(98)01076-8  0.419
1997 Perdew JP, Levy M. Comment on ``Significance of the highest occupied Kohn-Sham eigenvalue'' Physical Review B. 56: 16021-16028. DOI: 10.1103/Physrevb.56.16021  0.428
1997 Levy M, Perdew JP. Erratum: Tight bound and convexity constraint on the exchange-correlation-energy functionalsin the low-density limit, and other formal tests of generalized-gradient approximations [Phys. Rev. B 48, 11638 (1993)] Physical Review B. 55: 13321-13321. DOI: 10.1103/Physrevb.55.13321  0.384
1997 Görling A, Levy M. Hybrid schemes combining the Hartree-Fock method and density-functional theory: Underlying formalism and properties of correlation functionals Journal of Chemical Physics. 106: 2675-2680. DOI: 10.1063/1.473369  0.406
1997 Levy M. Additive density functional correlation corrections to single particle theories International Journal of Quantum Chemistry. 61: 281-285. DOI: 10.1002/(Sici)1097-461X(1997)61:2<281::Aid-Qua10>3.0.Co;2-F  0.443
1996 Burke K, Perdew JP, Levy M. Improving energies by using exact electron densities. Physical Review. A. 53: R2915-R2917. PMID 9913323 DOI: 10.1103/Physreva.53.R2915  0.444
1996 Levy M, Görling A. Approach to density-functional ionization energy Physical Review B - Condensed Matter and Materials Physics. 53: 969-972. DOI: 10.1103/Physrevb.53.969  0.399
1996 Levy M, Görling A. Density-functional exchange identity from coordinate scaling Physical Review a - Atomic, Molecular, and Optical Physics. 53: 3140-3142. DOI: 10.1103/Physreva.53.3140  0.378
1996 Levy M, March NH, Handy NC. On the adiabatic connection method, and scaling of electron-electron interactions in the Thomas-Fermi limit Journal of Chemical Physics. 104: 1989-1992. DOI: 10.1063/1.470954  0.514
1996 Levy M. Elementary concepts in density functional theory Theoretical and Computational Chemistry. 4: 3-24. DOI: 10.1016/S1380-7323(96)80083-5  0.348
1995 Levy M. Excitation energies from density-functional orbital energies Physical Review A. 52: R4313-R4315. DOI: 10.1103/Physreva.52.R4313  0.426
1995 Levy M, Görling A. Correlation-energy density-functional formulas from correlating first-order density matrices Physical Review A. 52: R1808-R1810. DOI: 10.1103/Physreva.52.R1808  0.426
1995 Görling A, Levy M. Hardness of molecules and the band gap of solids within the Kohn-Sham formalism: A perturbation-scaling approach Physical Review A. 52: 4493-4499. DOI: 10.1103/Physreva.52.4493  0.373
1995 Burke K, Perdew JP, Levy M. Nonlocal Density Functionals for Exchange and Correlation: Theory and Applications Theoretical and Computational Chemistry. 2: 47-66. DOI: 10.1007/978-94-011-0487-6_2  0.456
1995 G�rling A, Levy M. DFT ionization formulas and aDFT perturbation theory for exchange and correlation, through adiabatic connection International Journal of Quantum Chemistry. 56: 93-108. DOI: 10.1002/Qua.560560810  0.433
1995 Levy M, Görling A. New exact relations for improving the exchange and correlation potentials International Journal of Quantum Chemistry. 56: 385-388. DOI: 10.1002/Qua.560560424  0.395
1994 Görling A, Levy M. Exact Kohn-Sham scheme based on perturbation theory Physical Review A. 50: 196-204. DOI: 10.1103/Physreva.50.196  0.4
1994 Levy M, Görling A. Recent constrained-search advances for approximating density functionals Philosophical Magazine B: Physics of Condensed Matter; Statistical Mechanics, Electronic, Optical and Magnetic Properties. 69: 763-769. DOI: 10.1080/01418639408240145  0.324
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/Qua.560490416  0.443
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1994 Levy M, Perdew JP. Density functionals for exchange and correlation energies: Exact conditions and comparison of approximations International Journal of Quantum Chemistry. 49: 539-548. DOI: 10.1002/qua.560490416  0.325
1993 Levy M, Perdew JP. Tight bound and convexity constraint on the exchange-correlation-energy functional in the low-density limit, and other formal tests of generalized-gradient approximations. Physical Review. B, Condensed Matter. 48: 11638-11645. PMID 10007499 DOI: 10.1103/Physrevb.48.11638  0.324
1993 Görling A, Levy M, Perdew JP. Expectation values in density-functional theory, and kinetic contribution to the exchange-correlation energy. Physical Review. B, Condensed Matter. 47: 1167-1173. PMID 10006120 DOI: 10.1103/Physrevb.47.1167  0.383
1993 Zhao Q, Levy M, Parr RG. Applications of coordinate-scaling procedures to the exchange-correlation energy. Physical Review. A. 47: 918-922. PMID 9909011 DOI: 10.1103/Physreva.47.918  0.539
1993 Görling A, Levy M, Perdew JP. Expectation values in density-functional theory, and kinetic contribution to the exchange-correlation energy Physical Review B. 47: 1167-1173. DOI: 10.1103/PhysRevB.47.1167  0.311
1992 Görling A, Levy M. Requirements for correlation energy density functionals from coordinate transformations Physical Review A. 45: 1509-1517. DOI: 10.1103/Physreva.45.1509  0.385
1991 Ou-Yang H, Levy M. Theorem for functional derivatives in density-functional theory Physical Review A. 44: 54-58. DOI: 10.1103/Physreva.44.54  0.361
1991 Ou-Yang H, Levy M. Approximate noninteracting kinetic energy functionals from a nonuniform scaling requirement International Journal of Quantum Chemistry. 40: 379-388. DOI: 10.1002/Qua.560400309  0.324
1990 Ou-Yang H, Levy M. Theorem for exact local exchange potential Physical Review Letters. 65: 1036-1039. DOI: 10.1103/Physrevlett.65.1036  0.319
1990 Wilson LC, Levy M. Nonlocal Wigner-like correlation-energy density functional through coordinate scaling Physical Review B. 41: 12930-12932. DOI: 10.1103/Physrevb.41.12930  0.42
1990 Levy M, Ou-Yang H. Nonuniform coordinate scaling requirements for exchange-correlation energy Physical Review A. 42: 651-652. DOI: 10.1103/Physreva.42.651  0.338
1990 Levy M. Constrained-Search Formulation And Recent Coordinate Scaling In Density-Functional Theory Advances in Quantum Chemistry. 21: 69-95. DOI: 10.1016/S0065-3276(08)60592-4  0.4
1989 Cioslowski J, Levy M. Comment on "Density-matrix formulation of ab initio methods of nonrelativistic quantum mechanics" Physical Review. A. 40: 6727. PMID 9902073 DOI: 10.1103/Physreva.40.6727  0.52
1989 Cioslowski J, Levy M. Comment on Density-matrix formulation of ab initio methods of nonrelativistic quantum mechanics Physical Review A. 40: 6727. DOI: 10.1103/PhysRevA.40.6727  0.466
1988 Perdew JP, Levy M, Painter GS, Wei S, Lagowski JB. Chemical bond as a test of density-gradient expansions for kinetic and exchange energies. Physical Review. B, Condensed Matter. 37: 838-843. PMID 9944576 DOI: 10.1103/Physrevb.37.838  0.439
1988 Levy M, Hui Ou-Yang. Exact properties of the Pauli potential for the square root of the electron density and the kinetic energy functional Physical Review A. 38: 625-629. DOI: 10.1103/Physreva.38.625  0.427
1988 Politzer P, Levy M. Erratum: Energy differences from electrostatic potentials at nuclei [J. Chem. Phys. 87, 5044 (1987)] The Journal of Chemical Physics. 89: 2590-2590. DOI: 10.1063/1.455739  0.366
1987 Levy M, Pathak RK, Perdew JP, Wei S. Indirect-path methods for atomic and molecular energies, and new Koopmans theorems. Physical Review. A. 36: 2491-2494. PMID 9899151 DOI: 10.1103/Physreva.36.2491  0.32
1987 Levy M, Goldstein JA. Electron density-functional theory and x-ray structure factors Physical Review B. 35: 7887-7890. DOI: 10.1103/Physrevb.35.7887  0.355
1987 Osburn JE, Levy M. Energies, electron densities, and first-order density matrices from one-body external potentials. II Physical Review A. 35: 3233-3243. DOI: 10.1103/Physreva.33.2230  0.382
1987 Politzer P, Levy M. Energy differences from electrostatic potentials at nuclei The Journal of Chemical Physics. 87: 5044-5046. DOI: 10.1063/1.452823  0.374
1986 Sahni V, Levy M. Exchange and correlation energies in density-functional theory: Bounds from available data Physical Review B. 33: 3869-3872. DOI: 10.1103/Physrevb.33.3869  0.425
1986 Levy M, Perdew JP. Success of quantum mechanical approximations for molecular geometries and electron-nuclear attraction expectation values: Gift of the Coulomb potential? The Journal of Chemical Physics. 84: 4519-4523. DOI: 10.1063/1.450024  0.377
1985 Perdew JP, Levy M. Extrema of the density functional for the energy: Excited states from the ground-state theory. Physical Review. B, Condensed Matter. 31: 6264-6272. PMID 9935501 DOI: 10.1103/Physrevb.31.6264  0.325
1985 Levy M, Yang W, Parr RG. A new functional with homogeneous coordinate scaling in density functional theory: F[ρ, λ] The Journal of Chemical Physics. 83: 2334-2336. DOI: 10.1063/1.449326  0.612
1982 Perdew JP, Parr RG, Levy M, Balduz JL. Density-functional theory for fractional particle number: Derivative discontinuities of the energy Physical Review Letters. 49: 1691-1694. DOI: 10.1103/Physrevlett.49.1691  0.521
1982 Levy M. Electron densities in search of Hamiltonians Physical Review A. 26: 1200-1208. DOI: 10.1103/Physreva.26.1200  0.381
1982 Tal Y, Levy M. Recursion theory for nonrelativistic ground-state atomic energies and expectation values of r-1 Physical Review A. 25: 1838-1845. DOI: 10.1103/Physreva.25.1838  0.358
1982 Levy M, Tal Y, Clement SC. A discontinuous energy-density functional The Journal of Chemical Physics. 77: 3140-3147. DOI: 10.1063/1.444237  0.359
1982 Freed KF, Levy M. Direct first principles algorithm for the universal electron density functional The Journal of Chemical Physics. 77: 396-398. DOI: 10.1063/1.443619  0.38
1982 Levy M, Perdew JP. In defense of the Hohenberg-Kohn theorem and density functional theory International Journal of Quantum Chemistry. 21: 511-513. DOI: 10.1002/Qua.560210213  0.353
1980 Levy M, Tal Y. Energy-density relations and screening constants in atoms The Journal of Chemical Physics. 73: 5168-5173. DOI: 10.1063/1.439997  0.383
1979 Levy M. Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v-representability problem Proceedings of the National Academy of Sciences of the United States of America. 76: 6062-6065. DOI: 10.1073/Pnas.76.12.6062  0.428
1979 Levy M, Tal Y. Atomic binding energies from fundamental theorems involving the electron density, 〈r-1〉, and the Z-1 perturbation expansion The Journal of Chemical Physics. 72: 3416-3417. DOI: 10.1063/1.439527  0.381
1979 Levy M. On approximate energy differences from average electron densities The Journal of Chemical Physics. 70: 1573-1574. DOI: 10.1063/1.437557  0.44
1978 Parr RG, Donnelly RA, Levy M, Palke WE. Electronegativity: The density functional viewpoint The Journal of Chemical Physics. 68: 3801-3807. DOI: 10.1063/1.436185  0.566
1978 Levy M. An energy-density equation for isoelectronic changes in atoms The Journal of Chemical Physics. 68: 5298-5299. DOI: 10.1063/1.435604  0.326
1977 Levy M. Variational energy functionals involving one-electron operators The Journal of Chemical Physics. 67: 724-726. DOI: 10.1063/1.434879  0.4
1977 Howard RE, Levy M, Shull H, Hagstrom S. Transferability of electron pair wavefunctions. IV. Recreation of the hydrogen peroxide hindered rotation potential The Journal of Chemical Physics. 66: 5189-5201. DOI: 10.1063/1.433782  0.742
1977 Howard RE, Levy M, Shull H, Hagstrom S. Transferability of electron pair wavefunctions. III. A minimal basis strongly orthogonal geminal calculation of the hydrogen peroxide hindered rotation potential The Journal of Chemical Physics. 66: 5181-5188. DOI: 10.1063/1.433781  0.748
1976 Levy M. Long-range behavior of natural orbitals and electron density The Journal of Chemical Physics. 64: 2707. DOI: 10.1063/1.432492  0.311
1975 Levy M, Nee T, Parr RG. Method for direct determination of localized orbitals The Journal of Chemical Physics. 63: 316-318. DOI: 10.1063/1.431100  0.563
1974 Levy M. Transferability of intrageminal correlation energies and occupation coefficients The Journal of Chemical Physics. 61: 1857-1864. DOI: 10.1063/1.1682184  0.419
1974 Levy M, Stevens WJ, Shull H, Hagstrom S. Transferability of electron pairs between H2O and H 2O2 The Journal of Chemical Physics. 61: 1844-1856. DOI: 10.1063/1.1682183  0.759
1970 Levy MEL, Stevens WJ, Shull H, Hagstrom S. Transferability of strongly orthogonal geminals between H2O and H2O2, 1 The Journal of Chemical Physics. 52: 5485-5486. DOI: 10.1063/1.1672801  0.728
Show low-probability matches.