{ "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" [ [ 0.479191 0.660912 0.829083 ] [ 0.523819 0.001922 0.502871 ] [ 0.14582 0.561908 0.824266 ] [ 0.646551 0.939633 0.178314 ] [ 0.004048 0.181372 0.842703 ] [ 0.989596 0.485721 0.496978 ] [ 0.974157 0.839556 0.172545 ] [ 0.852032 0.102448 0.507536 ] [ 0.508227 0.31649 0.161299 ] [ 0.854815 0.768316 0.83924 ] [ 0.142254 0.897973 0.495179 ] [ 0.650343 0.267886 0.83996 ] [ 0.654385 0.604416 0.501264 ] [ 0.348966 0.065068 0.832291 ] [ 0.353219 0.398432 0.495766 ] [ 0.35769 0.735159 0.160442 ] [ 0.8447 0.433968 0.170427 ] [ 0.148011 0.22944 0.159459 ] [ 0.192781 0.854013 0.943793 ] [ 0.697366 0.974256 0.720144 ] [ 0.297893 0.36065 0.94366 ] [ 0.302703 0.692385 0.613721 ] [ 0.800827 0.479373 0.724072 ] [ 0.810799 0.811528 0.38566 ] [ 0.19914 0.187348 0.6105 ] [ 0.200045 0.524044 0.275762 ] [ 0.702243 0.307397 0.390247 ] [ 0.69354 0.645507 0.056773 ] [ 0.299685 0.021234 0.277132 ] [ 0.798504 0.138935 0.056684 ] [ 0.862378 0.977955 0.77688 ] [ 0.359405 0.853752 0.887743 ] [ 0.075186 0.745906 0.899787 ] [ 0.712465 0.692313 0.945052 ] [ 0.643601 0.809649 0.751449 ] [ 0.369658 0.51711 0.928526 ] [ 0.355954 0.857028 0.581975 ] [ 0.296372 0.643246 0.722809 ] [ 0.915388 0.592229 0.769343 ] [ 0.285419 0.975545 0.388779 ] [ 0.924962 0.919045 0.436351 ] [ 0.633632 0.477369 0.778444 ] [ 0.138836 0.348393 0.892125 ] [ 0.64272 0.811913 0.442823 ] [ 0.13808 0.687381 0.556814 ] [ 0.421668 0.240774 0.897468 ] [ 0.796239 0.199971 0.943279 ] [ 0.42014 0.578604 0.560391 ] [ 0.787823 0.526021 0.611802 ] [ 0.416324 0.908789 0.231864 ] [ 0.854984 0.313245 0.748214 ] [ 0.796346 0.854505 0.27549 ] [ 0.857152 0.641746 0.414917 ] [ 0.871238 0.983208 0.070897 ] [ 0.147345 0.023848 0.921524 ] [ 0.146591 0.35408 0.585443 ] [ 0.2127 0.14061 0.722851 ] [ 0.144792 0.688878 0.252845 ] [ 0.581093 0.088149 0.774224 ] [ 0.211469 0.471183 0.387279 ] [ 0.579166 0.428529 0.436542 ] [ 0.212168 0.80686 0.055978 ] [ 0.575821 0.755274 0.100714 ] [ 0.86225 0.318458 0.441105 ] [ 0.367136 0.189853 0.556631 ] [ 0.859163 0.64496 0.113572 ] [ 0.364741 0.521918 0.220976 ] [ 0.084602 0.075265 0.565264 ] [ 0.703024 0.023739 0.611009 ] [ 0.08206 0.410749 0.228264 ] [ 0.704353 0.366917 0.276782 ] [ 0.628296 0.152174 0.406915 ] [ 0.646208 0.476275 0.078901 ] [ 0.350856 0.188022 0.251795 ] [ 0.294298 0.301358 0.057333 ] [ 0.920223 0.258586 0.104414 ] [ 0.63816 0.150701 0.107683 ] [ 0.13416 0.020629 0.220966 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "V" "V" "V" "V" "V" "V" "V" "V" "V" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "P" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 8.40382672 "source-unit" "angstrom" } "b" { "source-value" 8.84446958 "source-unit" "angstrom" } "c" { "source-value" 13.52300752 "source-unit" "angstrom" } "alpha" { "source-value" 84.51035367 "source-unit" "degree" } "beta" { "source-value" 89.93665462 "source-unit" "degree" } "gamma" { "source-value" 89.87074561 "source-unit" "degree" } }