{ "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" [ [ 0.2343 0.760857 0.969805 ] [ 0.488921 0.725263 0.560797 ] [ 0.601913 0.744205 0.156296 ] [ 0.031372 0.785518 0.378876 ] [ 0.968628 0.214482 0.621124 ] [ 0.398087 0.255795 0.843704 ] [ 0.511079 0.274737 0.439203 ] [ 0.7657 0.239143 0.030195 ] [ 0.838914 0.73223 0.751466 ] [ 0.161086 0.26777 0.248534 ] [ 0.840214 0.853121 0.88398 ] [ 0.708963 0.93644 0.640005 ] [ 0.686624 0.567258 0.809341 ] [ 0.892447 0.417786 0.337142 ] [ 0.107553 0.582214 0.662858 ] [ 0.313376 0.432742 0.190659 ] [ 0.291037 0.06356 0.359995 ] [ 0.159786 0.146879 0.11602 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Si" "Si" "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" 6.59987037 "source-unit" "angstrom" } "b" { "source-value" 6.61374453 "source-unit" "angstrom" } "c" { "source-value" 9.89646293 "source-unit" "angstrom" } "alpha" { "source-value" 79.04846404 "source-unit" "degree" } "beta" { "source-value" 71.93702747 "source-unit" "degree" } "gamma" { "source-value" 65.98895771 "source-unit" "degree" } }