{ "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" [ [ 0.750023 0.015142 0.736504 ] [ 0.749528 0.48143 0.736533 ] [ 0.248416 0.98055 0.266729 ] [ 0.787086 0.726454 0.087026 ] [ 0.224157 0.750647 0.652575 ] [ 0.779616 0.258644 0.342502 ] [ 0.279199 0.251928 0.572557 ] [ 0.715054 0.752386 0.421028 ] [ 0.289837 0.752912 0.929611 ] [ 0.711225 0.248656 0.072896 ] [ 0.680435 0.243839 0.934443 ] [ 0.064187 0.74761 0.866423 ] [ 0.491293 0.746214 0.838084 ] [ 0.216605 0.06366 0.674675 ] [ 0.212638 0.437753 0.670095 ] [ 0.858446 0.752051 0.569571 ] [ 0.578796 0.25046 0.535326 ] [ 0.417704 0.760595 0.460856 ] [ 0.130099 0.245882 0.427431 ] [ 0.776946 0.566159 0.32448 ] [ 0.785232 0.937188 0.317465 ] [ 0.52212 0.251935 0.172241 ] [ 0.938389 0.254216 0.131959 ] [ 0.308903 0.763847 0.069312 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Ni" "Ni" "P" "P" "C" "C" "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" 5.15825381 "source-unit" "angstrom" } "b" { "source-value" 6.60390807 "source-unit" "angstrom" } "c" { "source-value" 8.97295662 "source-unit" "angstrom" } "alpha" { "source-value" 88.97478467 "source-unit" "degree" } "beta" { "source-value" 88.27593218 "source-unit" "degree" } "gamma" { "source-value" 89.7442407 "source-unit" "degree" } }