{ "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" [ [ 0.998021 0.993784 0.993724 ] [ 0.498021 0.006216 0.993724 ] [ 0.406298 0.470619 0.23025 ] [ 0.906298 0.529381 0.23025 ] [ 0.085482 0.463403 0.756015 ] [ 0.585482 0.536597 0.756015 ] [ 0.237894 0.991365 0.49374 ] [ 0.737894 0.008635 0.49374 ] [ 0.246841 0.212765 0.99555 ] [ 0.148632 0.689186 0.166619 ] [ 0.746841 0.787235 0.99555 ] [ 0.953984 0.203842 0.516778 ] [ 0.636546 0.802321 0.286328 ] [ 0.856916 0.804852 0.705405 ] [ 0.648632 0.310814 0.166619 ] [ 0.558487 0.261922 0.490396 ] [ 0.453984 0.796158 0.516778 ] [ 0.354291 0.663925 0.864041 ] [ 0.136546 0.197679 0.286328 ] [ 0.356916 0.195148 0.705405 ] [ 0.058487 0.738078 0.490396 ] [ 0.854291 0.336075 0.864041 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ta" "Ta" "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" 7.53222147 "source-unit" "angstrom" } "b" { "source-value" 5.44377442 "source-unit" "angstrom" } "c" { "source-value" 8.11149218 "source-unit" "angstrom" } "beta" { "source-value" 114.7938863 "source-unit" "degree" } }