{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.623457 0.141196 0.164562 ] [ 0.053971 0.716159 0.165241 ] [ 0.183117 0.330275 0.291215 ] [ 0.843007 0.158914 0.664878 ] [ 0.976978 0.47168 0.048052 ] [ 0.583324 0.67902 0.174642 ] [ 0.460877 0.997618 0.040952 ] [ 0.707307 0.333108 0.296277 ] [ 0.330421 0.152731 0.665013 ] [ 0.483532 0.504309 0.026652 ] [ 0.182249 0.857587 0.296088 ] [ 0.831783 0.660671 0.668991 ] [ 0.748894 0.501987 0.499516 ] [ 0.255603 0.995239 0.498864 ] [ 0.418441 0.335972 0.824374 ] [ 0.247663 0.499156 0.50793 ] [ 0.922688 0.829723 0.836188 ] [ 0.753721 0.998454 0.493759 ] [ 0.917354 0.329828 0.838779 ] [ 0.417975 0.835433 0.829718 ] [ 0.040924 0.324364 0.579859 ] [ 0.713238 0.163467 0.896732 ] [ 0.956553 0.172969 0.429493 ] [ 0.641171 0.492706 0.760781 ] [ 0.550313 0.832299 0.5726 ] [ 0.451467 0.668419 0.435974 ] [ 0.204656 0.671488 0.895714 ] [ 0.105444 0.014811 0.760836 ] [ 0.565655 0.325436 0.57177 ] [ 0.207701 0.176913 0.896813 ] [ 0.428499 0.169461 0.437208 ] [ 0.101932 0.504256 0.759693 ] [ 0.04495 0.847679 0.570843 ] [ 0.950659 0.646616 0.43721 ] [ 0.716738 0.667559 0.901473 ] [ 0.634628 0.991454 0.754387 ] [ 0.303801 0.334736 0.075391 ] [ 0.879285 0.509659 0.244634 ] [ 0.778489 0.819459 0.089621 ] [ 0.385792 0.0034 0.246859 ] [ 0.755739 0.349058 0.088317 ] [ 0.37687 0.509155 0.254648 ] [ 0.306937 0.80494 0.08896 ] [ 0.872866 0.003969 0.251823 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "V" "V" "V" "V" "V" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 5.96284031 "source-unit" "angstrom" } "b" { "source-value" 5.99791514 "source-unit" "angstrom" } "c" { "source-value" 15.1785318 "source-unit" "angstrom" } "alpha" { "source-value" 84.25262162 "source-unit" "degree" } "beta" { "source-value" 78.84448875 "source-unit" "degree" } "gamma" { "source-value" 60.33342803 "source-unit" "degree" } }