Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry
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Published By WORLD SCIENTIFIC

9789810224424, 9789812830586

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Infrared Spectra and Binding Energies of Transition Metal–Monoligand Complexes

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0007 ◽

1995 ◽

pp. 219-285 ◽

Cited By ~ 3

Author(s):

René Fournier ◽

Imre Pápai

Keyword(s):

Transition Metal ◽

Infrared Spectra ◽

Binding Energies

FRONT MATTER

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_fmatter ◽

1995 ◽

pp. i-xii

Author(s):

Delano P. Chong

Correlation in Molecules

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0002 ◽

1995 ◽

pp. 53-78 ◽

Cited By ~ 1

Author(s):

S. Suba ◽

M. A. Whitehead

Reinterpretation of Electron Correlations within Density Functional Theory: Hartree, Local Density and Gradient Expansion Approximations via the Work Formalism of Electronic Structure

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0003 ◽

1995 ◽

pp. 79-128 ◽

Cited By ~ 2

Author(s):

VIRAHT SAHNI

Keyword(s):

Density Functional Theory ◽

Electronic Structure ◽

Density Functional ◽

Local Density ◽

Electron Correlations ◽

Functional Theory ◽

Gradient Expansion

Beyond the Kohn–Sham Determinant

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0004 ◽

1995 ◽

pp. 129-153 ◽

Cited By ~ 40

Author(s):

Andreas Savin

Time-Dependent Density Functional Response Theory for Molecules

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0005 ◽

1995 ◽

pp. 155-192 ◽

Cited By ~ 1173

Author(s):

MARK E. CASIDA

Keyword(s):

Functional Response ◽

Density Functional ◽

Time Dependent ◽

Response Theory ◽

Dependent Density

Structure, Magnetic Properties and Reactivities of Open-Shell Species From Density Functional and Self-Consistent Hybrid Methods

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0008 ◽

1995 ◽

pp. 287-334 ◽

Cited By ~ 100

Author(s):

VINCENZO BARONE

Keyword(s):

Magnetic Properties ◽

Density Functional ◽

Hybrid Methods ◽

Open Shell ◽

Self Consistent

Exact Relations for the Electron Density and Energy Functionals

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0001 ◽

1995 ◽

pp. 1-52 ◽

Cited By ~ 3

Author(s):

Á. Nagy

Keyword(s):

Electron Density ◽

Energy Functionals ◽

Exact Relations

Evaluation and Application of Corrected Effective Medium Methods

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0006 ◽

1995 ◽

pp. 193-218 ◽

Cited By ~ 2

Author(s):

ANDREW E. DEPRISTO

Keyword(s):

Effective Medium

The Electron Density as Calculated From Density Functional Theory

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry ◽

10.1142/9789812830586_0010 ◽

1995 ◽

pp. 369-401 ◽

Cited By ~ 6

Author(s):

Russell J. Boyd ◽

Jian Wang ◽

Leif A. Eriksson

Keyword(s):

Density Functional Theory ◽

Electron Density ◽

Density Functional ◽

Functional Theory

Recent Advances in Density Functional Methods - Recent Advances in Computational ChemistryLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By WORLD SCIENTIFIC

Infrared Spectra and Binding Energies of Transition Metal–Monoligand Complexes

FRONT MATTER

Correlation in Molecules

Reinterpretation of Electron Correlations within Density Functional Theory: Hartree, Local Density and Gradient Expansion Approximations via the Work Formalism of Electronic Structure

Beyond the Kohn–Sham Determinant

Time-Dependent Density Functional Response Theory for Molecules

Structure, Magnetic Properties and Reactivities of Open-Shell Species From Density Functional and Self-Consistent Hybrid Methods

Exact Relations for the Electron Density and Energy Functionals

Evaluation and Application of Corrected Effective Medium Methods

The Electron Density as Calculated From Density Functional Theory

Recent Advances in Density Functional Methods - Recent Advances in Computational Chemistry
Latest Publications