{ "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" [ [ 0.928662 0.725111 0.870081 ] [ 0.071338 0.274889 0.129919 ] [ 0.439497 0.853849 0.84872 ] [ 0.560503 0.146151 0.15128 ] [ 0.772591 0.848096 0.451008 ] [ 0.151928 0.702347 0.2229 ] [ 0.583974 0.619808 0.222283 ] [ 0.416026 0.380192 0.777717 ] [ 0.848072 0.297653 0.7771 ] [ 0.227409 0.151904 0.548992 ] [ 0.259096 0.971412 0.667568 ] [ 0.71334 0.849026 0.660016 ] [ 0.196866 0.866583 0.074449 ] [ 0.637326 0.768676 0.058104 ] [ 0.008259 0.779485 0.409526 ] [ 0.667028 0.674442 0.395359 ] [ 0.34612 0.644313 0.311064 ] [ 0.357881 0.585594 0.80415 ] [ 0.935109 0.46574 0.826277 ] [ 0.064891 0.53426 0.173723 ] [ 0.642119 0.414406 0.19585 ] [ 0.65388 0.355687 0.688936 ] [ 0.332972 0.325558 0.604641 ] [ 0.991741 0.220515 0.590474 ] [ 0.362674 0.231324 0.941896 ] [ 0.803134 0.133417 0.925551 ] [ 0.28666 0.150974 0.339984 ] [ 0.740904 0.028588 0.332432 ] ] } "species" { "source-value" [ "Li" "Li" "Fe" "Fe" "P" "P" "P" "P" "P" "P" "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" 6.80583244 "source-unit" "angstrom" } "b" { "source-value" 7.07361341 "source-unit" "angstrom" } "c" { "source-value" 7.40666504 "source-unit" "angstrom" } "alpha" { "source-value" 84.04074935 "source-unit" "degree" } "beta" { "source-value" 77.19689091 "source-unit" "degree" } "gamma" { "source-value" 84.67761465 "source-unit" "degree" } }