Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry
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Published By WORLD SCIENTIFIC

9789814436724, 9789814436731

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Quantum Fluctuations, Dequantization, Information Theory and Kinetic-Energy Functionals

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0015 ◽

2013 ◽

pp. 401-425

Author(s):

I. P. Hamilton ◽

R. A. Mosna ◽

L. Delle Site

Keyword(s):

Information Theory ◽

Kinetic Energy ◽

Quantum Fluctuations ◽

Energy Functionals

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Semilocal Approximations for the Kinetic Energy

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0016 ◽

2013 ◽

pp. 429-442 ◽

Cited By ~ 12

Author(s):

Fabien Tran ◽

Tomasz A. Wesolowski

Keyword(s):

Kinetic Energy

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FRONT MATTER

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_fmatter ◽

2013 ◽

pp. i-xi

Author(s):

Tomasz A Wesolowski ◽

Yan Alexander Wang

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The Single-Particle Kinetic Energy of Many-Fermion Systems: Transcending the Thomas-Fermi plus Von Weizsäcker Method

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0003 ◽

2013 ◽

pp. 31-53

Author(s):

G. G. N. Angilella ◽

N. H. March

Keyword(s):

Kinetic Energy ◽

Single Particle ◽

Thomas Fermi ◽

Fermion Systems ◽

Particle Kinetic Energy

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Orbital-Free Embedding Calculations of Electronic Spectra

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0011 ◽

2013 ◽

pp. 323-354 ◽

Cited By ~ 4

Author(s):

Johannes Neugebauer

Keyword(s):

Electronic Spectra ◽

Orbital Free

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Properties of Hot and Dense Matter by Orbital-Free Molecular Dynamics

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0006 ◽

2013 ◽

pp. 165-201 ◽

Cited By ~ 3

Author(s):

Flavien Lambert ◽

Jean Clérouin ◽

Jean-François Danel ◽

Luc Kazandjian ◽

Stéphane Mazevet

Keyword(s):

Molecular Dynamics ◽

Dense Matter ◽

Orbital Free

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Analytic Approach and Monte Carlo Sampling for Electron Correlations

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0013 ◽

2013 ◽

pp. 369-386

Author(s):

Luca M. Ghiringhelli ◽

Luigi Delle Site

Keyword(s):

Monte Carlo ◽

Monte Carlo Sampling ◽

Analytic Approach ◽

Electron Correlations

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Towards the Description of Covalent Bonds in Subsystem Density-Functional Theory

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0010 ◽

2013 ◽

pp. 297-322 ◽

Cited By ~ 4

Author(s):

Christoph R. Jacob ◽

Lucas Visscher

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Covalent Bonds ◽

Functional Theory

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Electronic Structure Calculations at Macroscopic Scales using Orbital-Free DFT

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0005 ◽

2013 ◽

pp. 147-163 ◽

Cited By ~ 2

Author(s):

Balachandran G. Radhakrishnan ◽

Vikram Gavini

Keyword(s):

Electronic Structure ◽

Electronic Structure Calculations ◽

Orbital Free ◽

Structure Calculations

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Kinetic Energy and Fisher Information

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry ◽

10.1142/9789814436731_0014 ◽

2013 ◽

pp. 387-400

Author(s):

Ágnes Nagy

Keyword(s):

Kinetic Energy ◽

Fisher Information

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Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational ChemistryLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By WORLD SCIENTIFIC

Quantum Fluctuations, Dequantization, Information Theory and Kinetic-Energy Functionals

Semilocal Approximations for the Kinetic Energy

FRONT MATTER

The Single-Particle Kinetic Energy of Many-Fermion Systems: Transcending the Thomas-Fermi plus Von Weizsäcker Method

Orbital-Free Embedding Calculations of Electronic Spectra

Properties of Hot and Dense Matter by Orbital-Free Molecular Dynamics

Analytic Approach and Monte Carlo Sampling for Electron Correlations

Towards the Description of Covalent Bonds in Subsystem Density-Functional Theory

Electronic Structure Calculations at Macroscopic Scales using Orbital-Free DFT

Kinetic Energy and Fisher Information

Recent Progress in Orbital-free Density Functional Theory - Recent Advances in Computational Chemistry
Latest Publications