{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.723574 0.155691 ] [ 0.75 0.276426 0.844309 ] [ 0.25 0.223574 0.344309 ] [ 0.75 0.776426 0.655691 ] [ 0.25 0.09372 0.650741 ] [ 0.75 0.40628 0.150741 ] [ 0.25 0.59372 0.849259 ] [ 0.75 0.90628 0.349259 ] [ 0.75 0.409878 0.538676 ] [ 0.25 0.090122 0.038676 ] [ 0.75 0.909878 0.961324 ] [ 0.25 0.590122 0.461324 ] ] } "species" { "source-value" [ "La" "La" "La" "La" "Te" "Te" "Te" "Te" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.20633672 "source-unit" "angstrom" } "b" { "source-value" 7.89170098 "source-unit" "angstrom" } "c" { "source-value" 10.42277044 "source-unit" "angstrom" } }