{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1ab" } "basis-atom-coordinates" { "source-value" [ [ 0.999866 0.596486 0.384587 ] [ 0.499866 0.403514 0.615413 ] [ 0.499866 0.903514 0.384587 ] [ 0.999866 0.096486 0.615413 ] [ 0.511604 0.418786 0.119575 ] [ 0.511604 0.918786 0.880425 ] [ 0.011604 0.081214 0.119575 ] [ 0.011604 0.581214 0.880425 ] [ 0.147954 0.390517 0.08397 ] [ 0.647954 0.609483 0.91603 ] [ 0.647954 0.109483 0.08397 ] [ 0.147954 0.890517 0.91603 ] [ 0.590576 0.03761 0.656825 ] [ 0.090576 0.46239 0.656825 ] [ 0.090576 0.96239 0.343175 ] [ 0.590576 0.53761 0.343175 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Si" "Si" "Si" "Si" "N" "N" "N" "N" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.78699144 "source-unit" "angstrom" } "b" { "source-value" 5.23978209 "source-unit" "angstrom" } "c" { "source-value" 6.44495629 "source-unit" "angstrom" } }