{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnmm" } "basis-atom-coordinates" { "source-value" [ [ 0.157459 0.25 0.01635 ] [ 0.157459 0.25 0.48365 ] [ 0.842541 0.75 0.98365 ] [ 0.842541 0.75 0.51635 ] [ 0.57294 0.25 0.25 ] [ 0.42706 0.75 0.75 ] [ 0.06748 0.56189 0.25 ] [ 0.06748 0.93811 0.25 ] [ 0.93252 0.06189 0.75 ] [ 0.93252 0.43811 0.75 ] [ 0.663491 0.25 0.644807 ] [ 0.663491 0.25 0.855193 ] [ 0.336509 0.75 0.355193 ] [ 0.336509 0.75 0.144807 ] [ 0.300295 0.25 0.75 ] [ 0.699705 0.75 0.25 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.24731216 "source-unit" "angstrom" } "b" { "source-value" 7.31261324 "source-unit" "angstrom" } "c" { "source-value" 13.26010358 "source-unit" "angstrom" } }