{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.930559 0.5 0.279512 ] [ 0.061051 0 0.718165 ] [ 0.444264 0 0.213679 ] [ 0.545026 0.5 0.783837 ] [ 0.100774 0.5 0.590513 ] [ 0.38363 0.5 0.104226 ] [ 0.633845 0 0.909447 ] [ 0.884612 0 0.395769 ] [ 0.16129 0.5 0.44712 ] [ 0.247262 0.322072 0.667508 ] [ 0.247262 0.677928 0.667508 ] [ 0.19291 0 0.384123 ] [ 0.328188 0 0.901346 ] [ 0.253495 0.317159 0.177668 ] [ 0.253495 0.682841 0.177668 ] [ 0.293132 0.5 0.959232 ] [ 0.730365 0 0.052864 ] [ 0.762499 0.821619 0.830284 ] [ 0.762499 0.178381 0.830284 ] [ 0.687306 0.5 0.11875 ] [ 0.797577 0.5 0.611314 ] [ 0.744923 0.820501 0.319995 ] [ 0.744923 0.179499 0.319995 ] [ 0.809113 0 0.539197 ] ] } "species" { "source-value" [ "Mn" "Sb" "Sb" "Sb" "P" "P" "P" "P" "O" "O" "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" 4.9901343 "source-unit" "angstrom" } "b" { "source-value" 6.70251396 "source-unit" "angstrom" } "c" { "source-value" 10.29671101 "source-unit" "angstrom" } "beta" { "source-value" 91.3073088 "source-unit" "degree" } }