{ "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" [ [ 0.810951 0.850166 0.21708 ] [ 0.189049 0.350166 0.28292 ] [ 0.810951 0.649834 0.71708 ] [ 0.189049 0.149834 0.78292 ] [ 0.310181 0.837774 0.197681 ] [ 0.689819 0.337774 0.302319 ] [ 0.310181 0.662226 0.697681 ] [ 0.689819 0.162226 0.802319 ] [ 0.351938 0.893672 0.017326 ] [ 0.387998 0.285866 0.115414 ] [ 0.103971 0.654378 0.105407 ] [ 0.830976 0.505322 0.252444 ] [ 0.612002 0.785866 0.384586 ] [ 0.169024 0.005322 0.247556 ] [ 0.896029 0.154378 0.394593 ] [ 0.648062 0.393672 0.482674 ] [ 0.351938 0.606328 0.517326 ] [ 0.103971 0.845622 0.605407 ] [ 0.830976 0.994678 0.752444 ] [ 0.387998 0.214134 0.615414 ] [ 0.169024 0.494678 0.747556 ] [ 0.896029 0.345622 0.894593 ] [ 0.612002 0.714134 0.884586 ] [ 0.648062 0.106328 0.982674 ] ] } "species" { "source-value" [ "Sm" "Sm" "Sm" "Sm" "As" "As" "As" "As" "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" 6.71668095 "source-unit" "angstrom" } "b" { "source-value" 7.11763662 "source-unit" "angstrom" } "c" { "source-value" 8.29091791 "source-unit" "angstrom" } "beta" { "source-value" 126.13830027 "source-unit" "degree" } }