Ab Initio Studies on the Stopping Power of Warm Dense Matter with Time-Dependent Orbital-Free Density Functional Theory

Physical Review Letters ◽

10.1103/physrevlett.121.145001 ◽

2018 ◽

Vol 121 (14) ◽

Author(s):

Y. H. Ding ◽

A. J. White ◽

S. X. Hu ◽

O. Certik ◽

L. A. Collins

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Density Functional ◽

Dense Matter ◽

Time Dependent ◽

Stopping Power ◽

Warm Dense Matter ◽

Functional Theory ◽

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Time-dependent orbital-free density functional theory for electronic stopping power: Comparison to the Mermin-Kohn-Sham theory at high temperatures

Physical Review B ◽

10.1103/physrevb.98.144302 ◽

2018 ◽

Vol 98 (14) ◽

Author(s):

Alexander J. White ◽

Ondrej Certik ◽

Y. H. Ding ◽

S. X. Hu ◽

Lee A. Collins

Keyword(s):

Density Functional Theory ◽

High Temperatures ◽

Density Functional ◽

Time Dependent ◽

Stopping Power ◽

Power Comparison ◽

Functional Theory ◽

Orbital Free ◽

Electronic Stopping Power

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Electronic stopping power from time-dependent density-functional theory in Gaussian basis

The European Physical Journal B ◽

10.1140/epjb/e2018-90289-y ◽

2018 ◽

Vol 91 (8) ◽

Author(s):

Ivan Maliyov ◽

Jean-Paul Crocombette ◽

Fabien Bruneval

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Time Dependent ◽

Stopping Power ◽

Functional Theory ◽

Dependent Density ◽

Electronic Stopping Power

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Understanding Quantum Plasmonics from Time-Dependent Orbital-Free Density Functional Theory

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.6b05841 ◽

2016 ◽

Vol 120 (26) ◽

pp. 14330-14336 ◽

Author(s):

Hongping Xiang ◽

Mingliang Zhang ◽

Xu Zhang ◽

Gang Lu

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Time Dependent ◽

Functional Theory ◽

Quantum Plasmonics ◽

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Electronic Spectrum of Tryptophan-Phenylalanine. A Correlated Ab Initio and Time-Dependent Density Functional Theory Study

The Journal of Physical Chemistry B ◽

10.1021/jp906969n ◽

2009 ◽

Vol 113 (51) ◽

pp. 16443-16448 ◽

Author(s):

Carine Clavaguéra ◽

François Piuzzi ◽

Jean-Pierre Dognon

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Electronic Spectrum ◽

Density Functional ◽

Time Dependent ◽

Density Functional Theory Study ◽

Functional Theory ◽

Dependent Density

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Density functional theory for dielectric properties of warm dense matter

Molecular Physics ◽

10.1080/00268976.2015.1078508 ◽

2015 ◽

pp. 1-7 ◽

Author(s):

I. M. Saitov

Keyword(s):

Density Functional Theory ◽

Dielectric Properties ◽

Density Functional ◽

Dense Matter ◽

Warm Dense Matter ◽

Functional Theory

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Electronically Excited States of Vitamin B12: Benchmark Calculations Including Time-Dependent Density Functional Theory and Correlated ab Initio Methods

The Journal of Physical Chemistry A ◽

10.1021/jp110914y ◽

2011 ◽

Vol 115 (7) ◽

pp. 1280-1292 ◽

Author(s):

Karina Kornobis ◽

Neeraj Kumar ◽

Bryan M. Wong ◽

Piotr Lodowski ◽

Maria Jaworska ◽

...

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Excited States ◽

Density Functional ◽

Time Dependent ◽

Ab Initio Methods ◽

Functional Theory ◽

Electronically Excited States ◽

Electronically Excited ◽

Dependent Density

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Including nonlocality in the exchange-correlation kernel from time-dependent current density functional theory: Application to the stopping power of electron liquids

Physical Review B ◽

10.1103/physrevb.76.205103 ◽

2007 ◽

Vol 76 (20) ◽

Author(s):

V. U. Nazarov ◽

J. M. Pitarke ◽

Y. Takada ◽

G. Vignale ◽

Y.-C. Chang

Keyword(s):

Density Functional Theory ◽

Current Density ◽

Density Functional ◽

Time Dependent ◽

Stopping Power ◽

Functional Theory ◽

Correlation Kernel ◽

Exchange Correlation ◽

Electron Liquids ◽

Theory Application

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Density-functional-theory calculations of the optical properties of Al2O3: From solid-state to warm dense matter conditions

High Energy Density Physics ◽

10.1016/j.hedp.2019.100718 ◽

2019 ◽

Vol 33 ◽

pp. 100718

Author(s):

Gareth O. Williams ◽

Marta Fajardo

Keyword(s):

Density Functional Theory ◽

Optical Properties ◽

Solid State ◽

Density Functional ◽

Dense Matter ◽

Density Functional Theory Calculations ◽

Warm Dense Matter ◽

Functional Theory

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Ab Initio Computational Approach for Nanophotonics Based on Time-Dependent Density Functional Theory

10.1007/978-3-030-71516-8_4 ◽

2021 ◽

pp. 103-133

Author(s):

Kazuhiro Yabana ◽

Takashi Takeuchi ◽

Mitsuharu Uemoto ◽

Atsushi Yamada ◽

Shunsuke Yamada

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Density Functional ◽

Computational Approach ◽

Time Dependent ◽

Functional Theory ◽

Dependent Density

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Ab initio formation energies and time-dependent density functional theory excitation energies for nickel–nitrogen defect sites in diamond nanoparticles

MRS Communications ◽

10.1557/mrc.2018.39 ◽

2018 ◽

Vol 8 (02) ◽

pp. 453-458

Author(s):

Nicholas W. Gothard ◽

Douglas S. Dudis ◽

Luke J. Bissell

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Density Functional ◽

Time Dependent ◽

Excitation Energies ◽

Functional Theory ◽

Defect Sites ◽

Image Position ◽

Formation Energies ◽

Dependent Density

Abstract

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