{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.180006 0.499091 0.742056 ] [ 0.819994 0.500909 0.257944 ] [ 0.695601 0.949623 0.789983 ] [ 0.304399 0.050377 0.210017 ] [ 0.331591 0.855889 0.547091 ] [ 0.988867 0.794126 0.09102 ] [ 0.489226 0.758965 0.029427 ] [ 0.829893 0.661918 0.60134 ] [ 0.170107 0.338082 0.39866 ] [ 0.510774 0.241035 0.970573 ] [ 0.011133 0.205874 0.90898 ] [ 0.668409 0.144111 0.452909 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.11541682 "source-unit" "angstrom" } "b" { "source-value" 5.17223856 "source-unit" "angstrom" } "c" { "source-value" 5.18788111 "source-unit" "angstrom" } "alpha" { "source-value" 92.27351518 "source-unit" "degree" } "beta" { "source-value" 103.29759517 "source-unit" "degree" } "gamma" { "source-value" 90.42188895 "source-unit" "degree" } }