Ich stimme zu, dass diese Seite Cookies verwende. Weitere Informationen finden Sie unter unseren Datenschutzerklärungen .
X
Jørgen Mortensen, Jens
554  Ergebnisse:
Personensuche X
?
1

The Computational 2D Materials Database: high-throughput mo..:

Haastrup, Sten ; Strange, Mikkel ; Pandey, Mohnish...
2D Materials.  5 (2018)  4 - p. 042002 , 2018
Link: https://doi.org/10.1088/..
 
?
2

The atomic simulation environment—a Python library for work..:

Hjorth Larsen, Ask ; Jørgen Mortensen, Jens ; Blomqvist, Jakob...
Journal of Physics: Condensed Matter.  29 (2017)  27 - p. 273002 , 2017
Link: https://doi.org/10.1088/..
 
?
3

Chemisorption of gas atoms on one-dimensional transition-me..:

Moustafa, Hadeel ; Mortensen, Jens Jørgen ; Rossmeisl, Jan.
Applied Surface Science.  649 (2024)  - p. 159168 , 2024
Link: https://doi.org/10.1016/..
 
?
4

GPAW: An open Python package for electronic structure calcu..:

Mortensen, Jens Jørgen ; Larsen, Ask Hjorth ; Kuisma, Mikael...
The Journal of Chemical Physics.  160 (2024)  9 - p. , 2024
Link: https://doi.org/10.1063/..
 
?
5

Developments and applications of the OPTIMADE API for mater..:

Evans, Matthew ; Bergsma, Johan ; Merkys, Andrius...
Digital Discovery.  , 2024
Link: https://doi.org/10.1039/..
 
?
6

High-Throughput Search for Triplet Point Defects with Narro..:

Ali, Sajid ; Nilsson, Fredrik Andreas ; Manti, Simone...
ACS Nano.  , 2023
Link: https://doi.org/10.1021/..
 
?
7

Hundreds of new, stable, one-dimensional materials from a g..:

Moustafa, Hadeel ; Lyngby, Peder Meisner ; Mortensen, Jens Jørgen..
Physical Review Materials.  7 (2023)  1 - p. , 2023
Link: https://doi.org/10.1103/..
 
?
8

Computational exfoliation of atomically thin one-dimensiona..:

Moustafa, Hadeel ; Larsen, Peter Mahler ; Gjerding, Morten N....
Physical Review Materials.  6 (2022)  6 - p. , 2022
Link: https://doi.org/10.1103/..
 
?
9

Numerical quality control for DFT-based materials databases:

Carbogno, Christian ; Thygesen, Kristian Sommer ; Bieniek, Björn...
npj Computational Materials.  8 (2022)  1 - p. , 2022
Link: https://doi.org/10.1038/..
 
?
10

Atomic Simulation Recipes: A Python framework and library f..:

Gjerding, Morten ; Skovhus, Thorbjørn ; Rasmussen, Asbjørn...
Computational Materials Science.  199 (2021)  - p. 110731 , 2021
Link: https://doi.org/10.1016/..
 
?
11

Recent progress of the Computational 2D Materials Database ..:

Gjerding, Morten Niklas ; Taghizadeh, Alireza ; Rasmussen, Asbjørn...
2D Materials.  8 (2021)  4 - p. 044002 , 2021
Link: https://doi.org/10.1088/..
 
?
12

Efficient first principles simulation of electron scatterin..:

Susi, Toma ; Madsen, Jacob ; Ludacka, Ursula...
Ultramicroscopy.  197 (2019)  - p. 16-22 , 2019
Link: https://doi.org/10.1016/..
 
?
13

Reply to comment on 'The Computational 2D Materials Databas..:

Haastrup, Sten ; Strange, Mikkel ; Pandey, Mohnish...
2D Materials.  6 (2019)  4 - p. 048002 , 2019
Link: https://doi.org/10.1088/..
 
?
14

Interfacing CRYSTAL/AMBER to Optimize QM/MM Lennard–Jones P..:

Ougaard Dohn, Asmus ; Selli, Daniele ; Fazio, Gianluca...
Molecules.  23 (2018)  11 - p. 2958 , 2018
Link: https://doi.org/10.3390/..
 
?
15

Ab Initio van der Waals Interactions in Simulations of Wate..:

Møgelhøj, Andreas ; Kelkkanen, André K. ; Wikfeldt, K. Thor...
The Journal of Physical Chemistry B.  115 (2011)  48 - p. 14149-14160 , 2011
Link: https://doi.org/10.1021/..
 
1-15