{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.126664 0.446884 0.843275 ] [ 0.873901 0.762202 0.922875 ] [ 0.126099 0.237798 0.077125 ] [ 0.873336 0.553116 0.156725 ] [ 0.564025 0.180569 0.961753 ] [ 0.251061 0.011438 0.502807 ] [ 0.257532 0.523824 0.511669 ] [ 0.742468 0.476176 0.488331 ] [ 0.748939 0.988562 0.497193 ] [ 0.435975 0.819431 0.038247 ] [ 0.351584 0.325428 0.936448 ] [ 0.869461 0.323112 0.960297 ] [ 0.719223 0.98237 0.989983 ] [ 0.025593 0.055823 0.668106 ] [ 0.531154 0.052748 0.666106 ] [ 0.345837 0.613071 0.747065 ] [ 0.859293 0.563711 0.721148 ] [ 0.335221 0.299193 0.509847 ] [ 0.825881 0.258359 0.489454 ] [ 0.174119 0.741641 0.510546 ] [ 0.664779 0.700807 0.490153 ] [ 0.140707 0.436289 0.278852 ] [ 0.654163 0.386929 0.252935 ] [ 0.468846 0.947252 0.333894 ] [ 0.974407 0.944177 0.331894 ] [ 0.280777 0.01763 0.010017 ] [ 0.130539 0.676888 0.039703 ] [ 0.648416 0.674572 0.063552 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "Cu" "Cu" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.90740881 "source-unit" "angstrom" } "b" { "source-value" 7.6218935 "source-unit" "angstrom" } "c" { "source-value" 8.08586419 "source-unit" "angstrom" } "alpha" { "source-value" 106.37411874 "source-unit" "degree" } "beta" { "source-value" 94.77515986 "source-unit" "degree" } "gamma" { "source-value" 100.94818342 "source-unit" "degree" } }