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Inclusion of dispersion effects in density functional theory: Development and application
Møgelhøj, Andreas
(PhD Student)
Jacobsen, Karsten Wedel
(Main Supervisor)
Nørskov, Jens Kehlet
(Supervisor)
Brandbyge, Mads
(Examiner)
Mikkelsen, Kurt V.
(Examiner)
Jónsson, Hannes
(Examiner)
Department of Physics
Overview
Fingerprint
Publications
(1)
Project Details
Status
Finished
Effective start/end date
01/07/2009
→
22/08/2012
View all
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Fingerprint
Explore the research topics touched on by this project. These labels are generated based on the underlying awards/grants. Together they form a unique fingerprint.
Van Der Waals Force
Chemistry
100%
Molecular Dynamics
Chemistry
80%
Oxygen
Chemistry
39%
Density Functional Theory
Chemistry
39%
Sorption
Chemistry
39%
Liquid Water
Chemistry
39%
Catalysis
Chemistry
20%
Solid-State Chemistry
Chemistry
20%
Research output
Publications per year
2012
2012
2012
1
Ph.D. thesis
Publications per year
Publications per year
Inclusion of Dispersion Effects in Density Functional Theory: Development and Application
Møgelhøj, A.
,
2012
, Kgs. Lyngby:
Technical University of Denmark
.
207 p.
Research output
:
Book/Report
›
Ph.D. thesis
Open Access
File
Van Der Waals Force
100%
Molecular Dynamics
80%
Density Functional Theory
39%
Oxygen
39%
Liquid Water
39%
3414
Downloads (Pure)