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Advanced methods for total energy calculations of complex materials
Schmidt, Per Simmendefeldt
(PhD Student)
Thygesen, Kristian Sommer
(Main Supervisor)
Schiøtz, Jakob
(Examiner)
Rohlfing, Michael
(Examiner)
Grüneis, Andreas
(Examiner)
Department of Physics
Overview
Fingerprint
Publications
(1)
Project Details
Status
Finished
Effective start/end date
01/09/2014
→
15/11/2017
Funding
Technical University of Denmark
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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.
Functionals
Engineering
100%
Structure Calculation
Engineering
100%
Adsorption Energy
Engineering
100%
Density Functional Theory
Chemistry
100%
Electronic State
Chemistry
100%
Electronic Structure Calculation
Material Science
100%
Two-Dimensional Material
Material Science
100%
Bulk Material
Engineering
66%
Research output
Publications per year
2017
2017
2017
1
Ph.D. thesis
Publications per year
Publications per year
Development and application of advanced methods for electronic structure calculations
Schmidt, P. S.,
2017
,
Department of Physics, Technical University of Denmark
.
172 p.
Research output
:
Book/Report
›
Ph.D. thesis
Open Access
File
Structure Calculation
100%
Adsorption Energy
100%
Functionals
100%
Density Functional Theory
100%
Electronic State
100%
909
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