{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Im2m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.242426 0.834793 ] [ 0 0.242426 0.165207 ] [ 0.5 0.742426 0.334793 ] [ 0.5 0.742426 0.665207 ] [ 0.5 0.752352 0 ] [ 0 0.252352 0.5 ] [ 0 0.99618 0 ] [ 0.5 0.511608 0.837905 ] [ 0.5 0.511608 0.162095 ] [ 0.5 0.49618 0.5 ] [ 0 0.011608 0.337905 ] [ 0 0.011608 0.662095 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Ni" "Ni" "P" "P" "P" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.51721663064 "source-unit" "angstrom" } "b" { "source-value" 5.32754298211 "source-unit" "angstrom" } "c" { "source-value" 11.1540712423 "source-unit" "angstrom" } }