{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.843063 0 0.803944 ] [ 0.156937 0 0.196056 ] [ 0.343063 0.5 0.803944 ] [ 0.656937 0.5 0.196056 ] [ 0.641452 0.5 0.52857 ] [ 0.358548 0.5 0.47143 ] [ 0.905061 0.5 0.106777 ] [ 0.094939 0.5 0.893223 ] [ 0.141452 0 0.52857 ] [ 0.858548 0 0.47143 ] [ 0.405061 0 0.106777 ] [ 0.594939 0 0.893223 ] ] } "species" { "source-value" [ "Nb" "Nb" "Nb" "Nb" "As" "As" "As" "As" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.45182801 "source-unit" "angstrom" } "b" { "source-value" 3.4177812 "source-unit" "angstrom" } "c" { "source-value" 7.88498642 "source-unit" "angstrom" } "beta" { "source-value" 119.38627827 "source-unit" "degree" } }