{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.686889 0.68048 0.6779 ] [ 0.313111 0.31952 0.3221 ] [ 0.831959 0.839959 0.325811 ] [ 0.5 0.5 0 ] [ 0.168041 0.160041 0.674189 ] [ 0.33391 0.835332 0.332321 ] [ 0 0.5 0 ] [ 0.66609 0.164668 0.667679 ] [ 0.252248 0.719621 0.027229 ] [ 0.751955 0.715756 0.007208 ] [ 0.426905 0.933682 0.637225 ] [ 0.08797 0.60781 0.301318 ] [ 0.897978 0.942241 0.643347 ] [ 0.572436 0.611541 0.314799 ] [ 0.427564 0.388459 0.685201 ] [ 0.102022 0.057759 0.356653 ] [ 0.91203 0.39219 0.698682 ] [ 0.573095 0.066318 0.362775 ] [ 0.248045 0.284244 0.992792 ] [ 0.747752 0.280379 0.972771 ] ] } "species" { "source-value" [ "Li" "Li" "Cr" "Cr" "Cr" "Co" "Co" "Co" "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" 5.78639721 "source-unit" "angstrom" } "b" { "source-value" 5.9405057 "source-unit" "angstrom" } "c" { "source-value" 6.65628587 "source-unit" "angstrom" } "alpha" { "source-value" 105.22757319 "source-unit" "degree" } "beta" { "source-value" 102.78554116 "source-unit" "degree" } "gamma" { "source-value" 88.83353997 "source-unit" "degree" } }