TY  - CHART
AU  - Broeder, Jens
AU  - Wortmann, Daniel
AU  - Blügel, Stefan
TI  - JuCLS database of core-level shifts from all-electron density functional theory simulations for chemical analysis of X-ray photoelectron spectra
PB  - Materials Cloud
M1  - FZJ-2020-04307
PY  - 2020
KW  - core-level shifts (Other)
KW  - chemical shifts (Other)
KW  - binding energies (Other)
KW  - JuCLS (Other)
KW  - core-level (Other)
KW  - XPS (Other)
KW  - X-ray Photoelectron Spectroscopy (Other)
KW  - ESCA (Other)
KW  - FLAPW (Other)
KW  - Fleur (Other)
KW  - density functional theory (Other)
KW  - ab initio (Other)
KW  - aiida-fleur (Other)
KW  - MaX (Other)
LB  - PUB:(DE-HGF)32
DO  - DOI:10.24435/MATERIALSCLOUD:3J-P3
UR  - https://juser.fz-juelich.de/record/886179
ER  -