{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.203661 0.252873 0.661439 ] [ 0.203661 0.747127 0.661439 ] [ 0.80441 0 0.572629 ] [ 0.802337 0.751305 0.341862 ] [ 0.695569 0 0.076664 ] [ 0.303207 0.743937 0.162367 ] [ 0.303207 0.256063 0.162367 ] [ 0.802337 0.248695 0.341862 ] [ 0.225201 0.5 0.880545 ] [ 0.749177 0.696585 0.831708 ] [ 0.749177 0.303415 0.831708 ] [ 0.248222 0.5 0.39297 ] [ 0.796368 0.5 0.10632 ] [ 0.310723 0 0.415 ] [ 0.69133 0.5 0.585507 ] [ 0.189962 0 0.916598 ] [ 0.284053 0.199074 0.840282 ] [ 0.284053 0.800926 0.840282 ] [ 0.885922 0 0.921663 ] [ 0.20247 0.199738 0.34205 ] [ 0.306318 0 0.048768 ] [ 0.806053 0.291241 0.648698 ] [ 0.697399 0.707928 0.171681 ] [ 0.697399 0.292072 0.171681 ] [ 0.098307 0.5 0.101487 ] [ 0.20247 0.800262 0.34205 ] [ 0.613346 0 0.41441 ] [ 0.770045 0.5 0.448629 ] [ 0.20684 0 0.548367 ] [ 0.389572 0.5 0.595884 ] [ 0.806053 0.708759 0.648698 ] [ 0.67115 0.5 0.974385 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "P" "P" "P" "P" "O" "O" "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" 5.1321953933 "source-unit" "angstrom" } "b" { "source-value" 6.20359424 "source-unit" "angstrom" } "c" { "source-value" 10.8590550751 "source-unit" "angstrom" } "beta" { "source-value" 90.6393655253 "source-unit" "degree" } }