benchmark (id: 21) for Calcium Sulfate unhydrate ()

benchmark id: 21

added on 2020-04-11 13:20:17.483379 by masood.valavi@epfl.ch


type
system

description

references
files
  • none

results
type value unit error comment
lattice constant a 6.99 Å 0.0
lattice constant b 6.99 Å 0.0
lattice constant c 6.25 Å 0.0
angle alpha 90.0 ° 0.0
angle beta 90.0 ° 0.0
angle gamma 90.0 ° 0.0