{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.098674 0.5 0.702171 ] [ 0.899129 0.5 0.278146 ] [ 0.202887 0.5 0.289281 ] [ 0.598674 0 0.702171 ] [ 0.399129 0 0.278146 ] [ 0.702887 0 0.289281 ] [ 0.793255 0.5 0.688144 ] [ 0.293255 0 0.688144 ] [ 0.865871 0 0.307625 ] [ 0.756518 0 0.642519 ] [ 0.141939 0.5 0.014294 ] [ 0.053777 0.5 0.363712 ] [ 0.949118 0.5 0.644544 ] [ 0.861081 0.5 0.007032 ] [ 0.243222 0 0.354425 ] [ 0.134529 0 0.708106 ] [ 0.365871 0.5 0.307625 ] [ 0.256518 0.5 0.642519 ] [ 0.641939 0 0.014294 ] [ 0.553777 0 0.363712 ] [ 0.449118 0 0.644544 ] [ 0.361081 0 0.007032 ] [ 0.743222 0.5 0.354425 ] [ 0.634529 0.5 0.708106 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "V" "V" "Cr" "Cr" "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" 12.18686095 "source-unit" "angstrom" } "b" { "source-value" 3.83102063 "source-unit" "angstrom" } "c" { "source-value" 6.4720747 "source-unit" "angstrom" } "beta" { "source-value" 107.21070821 "source-unit" "degree" } }