{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.618589 0.062511 0.56902 ] [ 0.381411 0.562511 0.43098 ] [ 0.991774 0.996969 0.236524 ] [ 0.008226 0.496969 0.763476 ] [ 0.137032 0.261608 0.14033 ] [ 0.146216 0.241092 0.627889 ] [ 0.862968 0.761608 0.85967 ] [ 0.853784 0.741092 0.372111 ] [ 0.28814 0.118927 0.183477 ] [ 0.218366 0.409492 0.101555 ] [ 0.105018 0.734812 0.850668 ] [ 0.894982 0.234812 0.149332 ] [ 0.781634 0.909492 0.898445 ] [ 0.71186 0.618927 0.816523 ] [ 0.276001 0.391653 0.656732 ] [ 0.237317 0.10102 0.578242 ] [ 0.085356 0.752073 0.339131 ] [ 0.914644 0.252073 0.660869 ] [ 0.762683 0.60102 0.421758 ] [ 0.723999 0.891653 0.343268 ] ] } "species" { "source-value" [ "Li" "Li" "Co" "Co" "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" 5.22891948 "source-unit" "angstrom" } "b" { "source-value" 7.65438483 "source-unit" "angstrom" } "c" { "source-value" 6.45568652 "source-unit" "angstrom" } "beta" { "source-value" 113.77603993 "source-unit" "degree" } }