B
Atompaw input | Atompaw output | Comments | Datasets |
B.in | B |
B.LDA-PW-paw.xml.gz B.LDA-PW-paw.abinit.gz B.LDA-PW-paw.UPF.gz B.atomicdata.gz |
Tests
Material | Structure | Atomic datasets | Binding plot | Binding data |
BN | Zincblende structure F -4 3m (#216) |
Small core B Large core N |
BN plot | BN data |