{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.593569 0.993353 0.493328 ] [ 0.429569 0.497897 0.016546 ] [ 0.805583 0.476527 0.546544 ] [ 0.805583 0.523473 0.046544 ] [ 0.270018 0.16951 0.85449 ] [ 0.593569 0.006647 0.993328 ] [ 0.270018 0.83049 0.35449 ] [ 0.429569 0.502103 0.516546 ] [ 0.822714 0.203537 0.828163 ] [ 0.822714 0.796463 0.328163 ] [ 0.191479 0.709606 0.692005 ] [ 0.191479 0.290394 0.192005 ] [ 0.469006 0.091279 0.192128 ] [ 0.535108 0.60579 0.301725 ] [ 0.071328 0.575083 0.879066 ] [ 0.927039 0.081177 0.610561 ] [ 0.071328 0.424917 0.379066 ] [ 0.927039 0.918823 0.110561 ] [ 0.469006 0.908721 0.692128 ] [ 0.535108 0.39421 0.801725 ] [ 0.365573 0.546545 0.287547 ] [ 0.392503 0.054616 0.292338 ] [ 0.359414 0.223146 0.074683 ] [ 0.648663 0.712929 0.432678 ] [ 0.613539 0.578405 0.205153 ] [ 0.005865 0.447058 0.959405 ] [ 0.777148 0.192258 0.533243 ] [ 0.631308 0.019573 0.203177 ] [ 0.981677 0.571385 0.723862 ] [ 0.017232 0.097346 0.766987 ] [ 0.227623 0.686259 0.935823 ] [ 0.995471 0.931907 0.545965 ] [ 0.005865 0.552942 0.459405 ] [ 0.777148 0.807742 0.033243 ] [ 0.981677 0.428615 0.223862 ] [ 0.017232 0.902654 0.266987 ] [ 0.365573 0.453455 0.787547 ] [ 0.227623 0.313741 0.435823 ] [ 0.995471 0.068093 0.045965 ] [ 0.392503 0.945384 0.792338 ] [ 0.359414 0.776854 0.574683 ] [ 0.648663 0.287071 0.932678 ] [ 0.613539 0.421595 0.705153 ] [ 0.631308 0.980427 0.703177 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Sn" "Sn" "Sn" "Sn" "B" "B" "B" "B" "B" "B" "B" "B" "O" "O" "O" "O" "O" "O" "O" "O" "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" 8.15451901 "source-unit" "angstrom" } "b" { "source-value" 6.50745068 "source-unit" "angstrom" } "c" { "source-value" 9.94281803 "source-unit" "angstrom" } "beta" { "source-value" 115.81856674 "source-unit" "degree" } }