{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2cm" } "basis-atom-coordinates" { "source-value" [ [ 0.035639 0.018008 0.75 ] [ 0.035639 0.981992 0.25 ] [ 0.535639 0.518008 0.75 ] [ 0.535639 0.481992 0.25 ] [ 0.54219 0.187269 0.75 ] [ 0.07417 0 0.5 ] [ 0.07417 0 0 ] [ 0.54219 0.812731 0.25 ] [ 0.04219 0.687269 0.75 ] [ 0.57417 0.5 0.5 ] [ 0.57417 0.5 0 ] [ 0.04219 0.312731 0.25 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.24598605413 "source-unit" "angstrom" } "b" { "source-value" 7.82812450571 "source-unit" "angstrom" } "c" { "source-value" 9.5553077 "source-unit" "angstrom" } }