C
Atompaw input | Atompaw output | Comments | Datasets |
C.in | C |
C.LDA-PW-paw.xml.gz C.LDA-PW-paw.abinit.gz C.LDA-PW-paw.UPF.gz C.atomicdata.gz |
Tests
Material | Structure | Atomic datasets | Binding plot | Binding data |
C (diamond) | ||||
C | Diamond structure Fd -3m (#227) |
Large core C | C plot | C data |
TiC | NaCl structure Fm -3m (#225) |
Small core Ti Large core C |
TiC plot | TiC data |