{ "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" [ [ 0.327743 0.574366 0.67205 ] [ 0.672257 0.425634 0.32795 ] [ 0.067364 0.016732 0.71524 ] [ 0.665285 0.807788 0.046699 ] [ 0.334715 0.192212 0.953301 ] [ 0.932636 0.983268 0.28476 ] [ 0.190295 0.720905 0.98662 ] [ 0.273513 0.824712 0.385792 ] [ 0.726487 0.175288 0.614208 ] [ 0.809705 0.279095 0.01338 ] [ 0.26112 0.490518 0.022283 ] [ 0.065823 0.722148 0.378626 ] [ 0.220677 0.046951 0.306366 ] [ 0.034717 0.187811 0.897642 ] [ 0.367644 0.863875 0.992297 ] [ 0.269789 0.845959 0.549225 ] [ 0.152476 0.752146 0.831643 ] [ 0.50757 0.706227 0.309743 ] [ 0.49243 0.293773 0.690257 ] [ 0.847524 0.247854 0.168357 ] [ 0.730211 0.154041 0.450775 ] [ 0.632356 0.136125 0.007703 ] [ 0.965283 0.812189 0.102358 ] [ 0.779323 0.953049 0.693634 ] [ 0.934177 0.277852 0.621374 ] [ 0.73888 0.509482 0.977717 ] ] } "species" { "source-value" [ "Li" "Li" "Cr" "Cr" "Cr" "Cr" "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" 6.24437527 "source-unit" "angstrom" } "b" { "source-value" 6.36444681 "source-unit" "angstrom" } "c" { "source-value" 9.53564509 "source-unit" "angstrom" } "alpha" { "source-value" 85.22572079 "source-unit" "degree" } "beta" { "source-value" 73.54280293 "source-unit" "degree" } "gamma" { "source-value" 80.71656065 "source-unit" "degree" } }