{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1ab" } "basis-atom-coordinates" { "source-value" [ [ 0.88068 0.881146 0.375109 ] [ 0.88068 0.381146 0.624891 ] [ 0.38068 0.618854 0.375109 ] [ 0.38068 0.118854 0.624891 ] [ 0.00263 0.508565 0.25911 ] [ 0.50263 0.491435 0.74089 ] [ 0.50263 0.991435 0.25911 ] [ 0.00263 0.008565 0.74089 ] [ 0.11479 0.616907 0.863308 ] [ 0.11479 0.116907 0.136692 ] [ 0.61479 0.883093 0.863308 ] [ 0.61479 0.383093 0.136692 ] ] } "species" { "source-value" [ "Ge" "Ge" "Ge" "Ge" "Pt" "Pt" "Pt" "Pt" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.07660116 "source-unit" "angstrom" } "b" { "source-value" 6.10666747 "source-unit" "angstrom" } "c" { "source-value" 6.15643453 "source-unit" "angstrom" } }