{ "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 0 0 ] [ 0.737051 0.20198 0.674606 ] [ 0.262949 0.79802 0.325394 ] [ 0.636661 0.344553 0.21773 ] [ 0.363339 0.655447 0.78227 ] [ 0.380652 0.87367 0.633309 ] [ 0.619348 0.12633 0.366691 ] [ 0.220303 0.794716 0.023892 ] [ 0.779697 0.205284 0.976108 ] [ 0.688288 0.653792 0.840589 ] [ 0.859109 0.66758 0.356638 ] [ 0.140891 0.33242 0.643362 ] [ 0.311712 0.346208 0.159411 ] ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "As" "As" "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" 5.11414904719 "source-unit" "angstrom" } "b" { "source-value" 5.58368661669 "source-unit" "angstrom" } "c" { "source-value" 6.48608739021 "source-unit" "angstrom" } "alpha" { "source-value" 108.859398662 "source-unit" "degree" } "beta" { "source-value" 87.1555192578 "source-unit" "degree" } "gamma" { "source-value" 111.882566268 "source-unit" "degree" } }