{ "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" [ [ 0.961317 0.460783 0.827432 ] [ 0.537226 0.956843 0.663339 ] [ 0.137788 0.013383 0.346456 ] [ 0.319653 0.40291 0.147278 ] [ 0.632214 0.500348 0.49749 ] [ 0.971931 0.985092 0.994219 ] [ 0.373992 0.588327 0.794458 ] [ 0.901854 0.088511 0.709579 ] [ 0.662088 0.919754 0.291963 ] [ 0.762625 0.398308 0.200717 ] [ 0.227415 0.627289 0.945148 ] [ 0.733772 0.023871 0.82548 ] [ 0.617043 0.600618 0.744032 ] [ 0.112672 0.101615 0.750487 ] [ 0.279158 0.537455 0.685014 ] [ 0.858404 0.137062 0.562573 ] [ 0.577165 0.851027 0.443186 ] [ 0.920171 0.901856 0.239573 ] [ 0.957433 0.395831 0.263607 ] [ 0.514735 0.453991 0.297574 ] [ 0.492751 0.004101 0.195566 ] [ 0.807729 0.343733 0.048876 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ni" "Ni" "C" "C" "C" "C" "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" 5.39692723 "source-unit" "angstrom" } "b" { "source-value" 6.16095262 "source-unit" "angstrom" } "c" { "source-value" 8.38904406 "source-unit" "angstrom" } "alpha" { "source-value" 82.00735062 "source-unit" "degree" } "beta" { "source-value" 74.59313027 "source-unit" "degree" } "gamma" { "source-value" 64.50021828 "source-unit" "degree" } }