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Harbola, Manoj K., Parr, Robert G., Lee, Chengteh (1991) Hardnesses from electrostatic potentials. The Journal of Chemical Physics, 94 (9). 6055-6056 doi:10.1063/1.460443

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Reference TypeJournal (article/letter/editorial)
TitleHardnesses from electrostatic potentials
JournalThe Journal of Chemical Physics
AuthorsHarbola, Manoj K.Author
Parr, Robert G.Author
Lee, ChengtehAuthor
Year1991 (May)Volume94
Issue9
PublisherAIP Publishing
DOIdoi:10.1063/1.460443Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID2190612Long-form Identifiermindat:1:5:2190612:9
GUID0
Full ReferenceHarbola, Manoj K., Parr, Robert G., Lee, Chengteh (1991) Hardnesses from electrostatic potentials. The Journal of Chemical Physics, 94 (9). 6055-6056 doi:10.1063/1.460443
Plain TextHarbola, Manoj K., Parr, Robert G., Lee, Chengteh (1991) Hardnesses from electrostatic potentials. The Journal of Chemical Physics, 94 (9). 6055-6056 doi:10.1063/1.460443
In(1991, May) The Journal of Chemical Physics Vol. 94 (9) AIP Publishing

See Also

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Politzer, Peter, Parr, Robert G., Murphy, Danny R. (1983) Relationships between atomic chemical potentials, electrostatic potentials, and covalent radii. The Journal of Chemical Physics, 79 (8) 3859-3861 doi:10.1063/1.446251
Lee, Chengteh, Zdravkovic, Slobodan, Parr, Robert G. (1990) Additivity of the one‐third power of the electron density in the hydrogen molecule–ion and hydrogen molecule. The Journal of Chemical Physics, 92 (3). 2114-2115 doi:10.1063/1.457995
Lee, Chengteh, Sosa, Carlos (1994) Local density component of the Lee–Yang–Parr correlation energy functional. The Journal of Chemical Physics, 100 (12). 9018-9024 doi:10.1063/1.466706
Lee, Hsing, Lee, Chengteh, Parr, Robert G. (1991) Conjoint gradient correction to the Hartree-Fock kinetic- and exchange-energy density functionals. Physical Review A, 44 (1). 768-771 doi:10.1103/physreva.44.768
Silberbach, H. (1991) Comment on: Maximal and minimal characteristics of molecular electrostatic potentials. The Journal of Chemical Physics, 94 (12). 8638 doi:10.1063/1.460054
Lee, Chengteh, Parr, Robert G. (1990) Exchange-correlation functional for atoms and molecules. Physical Review A, 42 (1). 193-200 doi:10.1103/physreva.42.193
Lee, Chengteh, Yang, Weitao, Parr, Robert G. (1988) Local softness and chemical reactivity in the molecules CO, SCN− and H2CO. Journal of Molecular Structure: THEOCHEM, 163. 305-313 doi:10.1016/0166-1280(88)80397-x
Harbola, Manoj K., Zope, Rajendra R., Kshirsagar, Anjali, Pathak, Rajeev K. (2005) Momentum-space properties from coordinate-space electron density. The Journal of Chemical Physics, 122 (20). 204110pp. doi:10.1063/1.1904588
Fuentealba, Patricio, Parr, Robert G. (1991) Higher‐order derivatives in density‐functional theory, especially the hardness derivative ∂η/∂N. The Journal of Chemical Physics, 94 (8). 5559-5564 doi:10.1063/1.460491
Liu, Guang-Hua, Parr, Robert G. (1995) On Atomic and Orbital Electronegativities and Hardnesses. Journal Of The American Chemical Society, 117 (11) 3179-3188 doi:10.1021/ja00116a023
Chattaraj, Pratim K., Lee, Hsing, Parr, Robert G. (1991) HSAB principle. Journal Of The American Chemical Society, 113 (5) 1855-1856 doi:10.1021/ja00005a073
 
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