{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.238088 0.232825 0.169268 ] [ 0.238088 0.767175 0.669268 ] [ 0.740927 0.753512 0.330643 ] [ 0.74444 0.500698 0.09004 ] [ 0.74444 0.499302 0.59004 ] [ 0.740927 0.246488 0.830643 ] [ 0.740068 0.010205 0.583262 ] [ 0.740068 0.989795 0.083262 ] [ 0.237417 0.516761 0.912171 ] [ 0.237417 0.483239 0.412171 ] [ 0.738225 0.242082 0.33247 ] [ 0.738225 0.757918 0.83247 ] [ 0.235784 0.742602 0.167456 ] [ 0.235784 0.257398 0.667456 ] [ 0.413401 0.272051 0.329824 ] [ 0.844024 0.243229 0.187349 ] [ 0.359048 0.040649 0.613315 ] [ 0.80878 0.025836 0.405828 ] [ 0.80878 0.974164 0.905828 ] [ 0.359048 0.959351 0.113315 ] [ 0.844024 0.756771 0.687349 ] [ 0.413401 0.727949 0.829824 ] [ 0.912157 0.744499 0.167186 ] [ 0.344872 0.703959 0.311319 ] [ 0.861684 0.541707 0.904549 ] [ 0.331878 0.530214 0.082704 ] [ 0.331878 0.469786 0.582704 ] [ 0.861684 0.458293 0.404549 ] [ 0.344872 0.296041 0.811319 ] [ 0.912157 0.255501 0.667186 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "Si" "Si" "Si" "Si" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.07078695 "source-unit" "angstrom" } "b" { "source-value" 6.3389676 "source-unit" "angstrom" } "c" { "source-value" 10.78668596 "source-unit" "angstrom" } "beta" { "source-value" 90.08620375 "source-unit" "degree" } }