{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.792261 0.983628 0.206484 ] [ 0.792261 0.516372 0.206484 ] [ 0.207739 0.483628 0.793516 ] [ 0.207739 0.016372 0.793516 ] [ 0.253503 0.25 0.359961 ] [ 0.746497 0.75 0.640039 ] [ 0.277354 0.75 0.409835 ] [ 0.722646 0.25 0.590165 ] [ 0.260683 0.25 0.056699 ] [ 0.739317 0.75 0.943301 ] [ 0.720778 0.75 0.083472 ] [ 0.026895 0.25 0.121184 ] [ 0.478626 0.25 0.148817 ] [ 0.146297 0.935161 0.336846 ] [ 0.146297 0.564839 0.336846 ] [ 0.764427 0.25 0.417257 ] [ 0.591228 0.75 0.397037 ] [ 0.408772 0.25 0.602963 ] [ 0.235573 0.75 0.582743 ] [ 0.853703 0.435161 0.663154 ] [ 0.853703 0.064839 0.663154 ] [ 0.521374 0.75 0.851183 ] [ 0.973105 0.75 0.878816 ] [ 0.279222 0.25 0.916528 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ho" "Ho" "P" "P" "C" "C" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 4.92217381 "source-unit" "angstrom" } "b" { "source-value" 6.7747271 "source-unit" "angstrom" } "c" { "source-value" 8.98939363 "source-unit" "angstrom" } "beta" { "source-value" 92.77402948 "source-unit" "degree" } }