The PSI Center for Computing Scientific, Theory and Data links new opportunities of computational materials modelling and data science with PSI’s unique large research facilities.
Lab News & Scientific Highlights
Publications
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Burgess AC, Linscott E, O'Regan DD
Tilted-plane structure of the energy of finite quantum systems
Physical Review Letters. 2024; 133(2): 026404 (6 pp.). https://doi.org/10.1103/PhysRevLett.133.026404
DORA PSI -
Ponet L, Di Lucente E, Marzari N
The energy landscape of magnetic materials
npj Computational Materials. 2024; 10(1): 151 (7 pp.). https://doi.org/10.1038/s41524-024-01310-w
DORA PSI -
Evans ML, Bergsma J, Merkys A, Andersen CW, Andersson OB, Beltrán D, et al.
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
Digital Discovery. 2024. https://doi.org/10.1039/d4dd00039k
DORA PSI