Cu

Atompaw input Atompaw output Comments Datasets
Cu.in Cu Author: Chaochao Dun Cu.LDA-PW-paw.xml.gz
Cu.LDA-PW-paw.abinit.gz
Cu.LDA-PW-paw.UPF.gz
Cu.atomicdata.gz


Tests

Material Structure Atomic datasets Binding plot Binding data
CuCl Zincblende structure
F -4 3m (#216)
Small core Cu
Large core Cl
CuCl plot CuCl data