K
Atompaw input | Atompaw output | Comments | Datasets |
K.in | K | Author: Cameron Kates |
K.LDA-PW-paw.xml.gz K.LDA-PW-paw.abinit.gz K.LDA-PW-paw.UPF.gz K.atomicdata.gz |
Tests
Material | Structure | Atomic datasets | Binding plot | Binding data |
KCl | NaCl structure Fm -3m (#225) |
Small core K Large core Cl |
KCl plot | KCl data |
KBr | NaCl structure Fm -3m (#225) |
Small core K Large core Br |
KBr plot | KBr data |