{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbca" } "basis-atom-coordinates" { "source-value" [ [ 0.459713 0.106411 0.872682 ] [ 0.959713 0.393589 0.127318 ] [ 0.540287 0.606411 0.627318 ] [ 0.040287 0.893589 0.372682 ] [ 0.540287 0.893589 0.127318 ] [ 0.040287 0.606411 0.872682 ] [ 0.459713 0.393589 0.372682 ] [ 0.959713 0.106411 0.627318 ] [ 0.141848 0.082681 0.109309 ] [ 0.641848 0.417319 0.890691 ] [ 0.858152 0.582681 0.390691 ] [ 0.358152 0.917319 0.609309 ] [ 0.858152 0.917319 0.890691 ] [ 0.358152 0.582681 0.109309 ] [ 0.141848 0.417319 0.609309 ] [ 0.641848 0.082681 0.390691 ] ] } "species" { "source-value" [ "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Zn" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.28387175 "source-unit" "angstrom" } "b" { "source-value" 7.82284542 "source-unit" "angstrom" } "c" { "source-value" 8.23234625 "source-unit" "angstrom" } }