Dear siesta users, Has any one encountered the problem of negative value of projected DOS which is calculated with the mprop utility? It seems quite unreasonable for me, any ideas how this come out?
Best regards, Bing
Dear siesta users, Has any one encountered the problem of negative value of projected DOS which is calculated with the mprop utility? It seems quite unreasonable for me, any ideas how this come out?
Best regards, Bing