ChemInform Abstract: Average Local Ionization Energies: Significance and Applications

ChemInform ◽  
2010 ◽  
Vol 29 (41) ◽  
pp. no-no
Author(s):  
J. S. MURRAY ◽  
P. POLITZER
Keyword(s):  
Ionization Energies ◽  
Average Local Ionization Energies

Radial behavior of the average local ionization energies of atoms

1991 ◽  
Vol 95 (9) ◽  
pp. 6699-6704 ◽  
Author(s):  
Peter Politzer ◽  
Jane S. Murray ◽  
M. Edward Grice ◽  
Tore Brinck ◽  
Shoba Ranganathan
Keyword(s):  
Ionization Energies ◽  
Average Local Ionization Energies

Quantitative analysis of molecular surfaces: areas, volumes, electrostatic potentials and average local ionization energies

2010 ◽  
Vol 16 (11) ◽  
pp. 1679-1691 ◽  
Author(s):  
Felipe A. Bulat ◽  
Alejandro Toro-Labbé ◽  
Tore Brinck ◽  
Jane S. Murray ◽  
Peter Politzer
Keyword(s):  
Quantitative Analysis ◽  
Electrostatic Potentials ◽  
Ionization Energies ◽  
Molecular Surfaces ◽  
Average Local Ionization Energies

Average Local Ionization Energies in the Hartree−Fock and Kohn−Sham Theories

2009 ◽  
Vol 113 (7) ◽  
pp. 1384-1389 ◽  
Author(s):  
Felipe A. Bulat ◽  
Mel Levy ◽  
Peter Politzer
Keyword(s):  
Ionization Energies ◽  
Hartree Fock ◽  
Average Local Ionization Energies

Average local ionization energies computed on the surfaces of some strained molecules

1990 ◽  
Vol 38 (S24) ◽  
pp. 645-653 ◽  
Author(s):  
Jane S. Murray ◽  
Jorge M. Seminario ◽  
Peter Politzer ◽  
Per Sjoberg
Keyword(s):  
Ionization Energies ◽  
Strained Molecules ◽  
Average Local Ionization Energies

Computed electrostatic potentials and average local ionization energies on the molecular surfaces of some tetracyclines

2001 ◽  
Vol 82 (4) ◽  
pp. 160-169 ◽  
Author(s):  
Wedad Hussein ◽  
Christopher G. Walker ◽  
Zenaida Peralta-Inga ◽  
Jane S. Murray
Keyword(s):  
Electrostatic Potentials ◽  
Ionization Energies ◽  
Molecular Surfaces ◽  
Average Local Ionization Energies
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