{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.24931 0.5 ] [ 0.5 0.74931 0.5 ] [ 0 0.624694 0.5 ] [ 0.5 0.124694 0.5 ] [ 0.783715 0.963336 0.093895 ] [ 0.216285 0.963336 0.906105 ] [ 0.283715 0.463336 0.093895 ] [ 0.716285 0.463336 0.906105 ] [ 0.749614 0.108271 0.332442 ] [ 0.250386 0.108271 0.667558 ] [ 0.1673 0.77867 0.761403 ] [ 0.8327 0.77867 0.238597 ] [ 0.394674 0.943118 0.228103 ] [ 0.605326 0.943118 0.771897 ] [ 0 0.049884 0 ] [ 0.249614 0.608271 0.332442 ] [ 0.750386 0.608271 0.667558 ] [ 0.6673 0.27867 0.761403 ] [ 0.3327 0.27867 0.238597 ] [ 0.894674 0.443118 0.228103 ] [ 0.105326 0.443118 0.771897 ] [ 0.5 0.549884 0 ] ] } "species" { "source-value" [ "Li" "Li" "Ga" "Ga" "As" "As" "As" "As" "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" 6.74986302656 "source-unit" "angstrom" } "b" { "source-value" 8.34392902363 "source-unit" "angstrom" } "c" { "source-value" 4.77544044547 "source-unit" "angstrom" } "beta" { "source-value" 104.055268137 "source-unit" "degree" } }