1mo

gen_7 FeCoSnSb - relaxed - phonon dispersion

Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz

3 views

1108 x 761

285.99 KB

.png file

1 input asset

.cif file
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -92.7775 eV; energy change = -0.0324 eV; symmetry: C2/m → R-3m
1mo

Loading compatible actions...

Loading comments...