{ "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" [ [ 0.002292 0.460875 0.226968 ] [ 0.997307 0.007778 0.994828 ] [ 0.496145 0.508813 0.99939 ] [ 0.999731 0.002674 0.504196 ] [ 0.502235 0.506855 0.506933 ] [ 0.689277 0.197024 0.570589 ] [ 0.893331 0.015097 0.260469 ] [ 0.684813 0.812032 0.951826 ] [ 0.813885 0.692228 0.567997 ] [ 0.193881 0.690722 0.065737 ] [ 0.628524 0.508594 0.25665 ] [ 0.370055 0.507527 0.750621 ] [ 0.806091 0.326921 0.957353 ] [ 0.190336 0.318428 0.43818 ] [ 0.305933 0.211432 0.060233 ] [ 0.118008 0.008707 0.745345 ] [ 0.308157 0.80989 0.435484 ] ] } "species" { "source-value" [ "Li" "Nb" "Te" "Te" "Te" "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" 5.15627624 "source-unit" "angstrom" } "b" { "source-value" 5.37719763 "source-unit" "angstrom" } "c" { "source-value" 7.45862942 "source-unit" "angstrom" } "alpha" { "source-value" 86.94777496 "source-unit" "degree" } "beta" { "source-value" 89.99482896 "source-unit" "degree" } "gamma" { "source-value" 89.92228361 "source-unit" "degree" } }