{ "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" [ [ 0.127767 0.22024 0.276456 ] [ 0.627767 0.27976 0.276456 ] [ 0.872233 0.77976 0.723544 ] [ 0.372233 0.72024 0.723544 ] [ 0.117239 0.67765 0.002371 ] [ 0.382761 0.17765 0.997629 ] [ 0.617239 0.82235 0.002371 ] [ 0.874905 0.758623 0.365485 ] [ 0.625095 0.258623 0.634515 ] [ 0.882761 0.32235 0.997629 ] [ 0.374905 0.741377 0.365485 ] [ 0.125095 0.241377 0.634515 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Se" "Se" "Se" "Se" "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" 8.5627730726 "source-unit" "angstrom" } "b" { "source-value" 4.28006777 "source-unit" "angstrom" } "c" { "source-value" 8.63809200484 "source-unit" "angstrom" } "beta" { "source-value" 90.2111561003 "source-unit" "degree" } }