Ti
Atompaw input | Atompaw output | Comments | Datasets |
Ti.in | Ti | Author: Jamie Drewery |
Ti.LDA-PW-paw.xml.gz Ti.LDA-PW-paw.abinit.gz Ti.LDA-PW-paw.UPF.gz Ti.atomicdata.gz |
Tests
Material | Structure | Atomic datasets | Binding plot | Binding data |
TiC | NaCl structure Fm -3m (#225) |
Small core Ti Large core C |
TiC plot | TiC data |