Li

Atompaw input Atompaw output Comments Datasets
Li.in Li Li.LDA-PW-paw.xml.gz
Li.LDA-PW-paw.abinit.gz
Li.LDA-PW-paw.UPF.gz
Li.atomicdata.gz


Tests

Material Structure Atomic datasets Binding plot Binding data
LiF NaCl structure
Fm -3m (#225)
Small core Li
Large core F
LiF plot LiF data
Li2O Fluorite structure
Fm -3m (#225)
Small core Li
Large core O
Li2O plot Li2O data