{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.360076 0.319286 0.925243 ] [ 0.943975 0.627028 0.845422 ] [ 0.36813 0.804028 0.80755 ] [ 0.63187 0.304028 0.69245 ] [ 0.056025 0.127028 0.654578 ] [ 0.639924 0.819286 0.574757 ] [ 0.360076 0.180714 0.425243 ] [ 0.943975 0.872972 0.345422 ] [ 0.36813 0.695972 0.30755 ] [ 0.63187 0.195972 0.19245 ] [ 0.056025 0.372972 0.154578 ] [ 0.639924 0.680714 0.074757 ] [ 0.838867 0.088775 0.933347 ] [ 0.161133 0.588775 0.566653 ] [ 0.838867 0.411225 0.433347 ] [ 0.161133 0.911225 0.066653 ] [ 0.746276 0.353787 0.961966 ] [ 0.102945 0.042243 0.899859 ] [ 0.693649 0.938222 0.810123 ] [ 0.306351 0.438222 0.689877 ] [ 0.897055 0.542243 0.600141 ] [ 0.253724 0.853787 0.538034 ] [ 0.746276 0.146213 0.461966 ] [ 0.102945 0.457757 0.399859 ] [ 0.693649 0.561778 0.310123 ] [ 0.306351 0.061778 0.189877 ] [ 0.897055 0.957757 0.100141 ] [ 0.253724 0.646213 0.038034 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "Rb" "In" "In" "In" "In" "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" 7.89453781 "source-unit" "angstrom" } "b" { "source-value" 7.17845292 "source-unit" "angstrom" } "c" { "source-value" 11.57078326 "source-unit" "angstrom" } "beta" { "source-value" 94.38902394 "source-unit" "degree" } }