File: BORN_TiO2

package info (click to toggle)
phonopy 2.47.1-2
  • links: PTS, VCS
  • area: main
  • in suites: sid
  • size: 29,380 kB
  • sloc: python: 43,690; xml: 12,080; ansic: 3,227; cpp: 525; sh: 213; makefile: 20
file content (4 lines) | stat: -rw-r--r-- 408 bytes parent folder | download | duplicates (5) 
1
2
3
4
 
# epsilon and Z* of atoms 1 9
   7.10729047    0.00000000    0.00000000    0.00000000    7.10729047    0.00000000    0.00000000    0.00000000    6.41993410
  -5.54435990    0.00000000    0.00000000    0.00000000   -1.11960146   -0.00000000    0.00000000    0.00000000   -2.89515567
   6.66396136    0.00000000    0.00000000    0.00000000    6.66396136   -0.00000000    0.00000000    0.00000000    5.79031133