{ "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" [ [ 0.568919 0.820016 0.708027 ] [ 0.431376 0.656051 0.32613 ] [ 0.568624 0.343949 0.67387 ] [ 0.431081 0.179984 0.291973 ] [ 0.979252 0.892983 0.280042 ] [ 0.800729 0.656218 0.05373 ] [ 0.199271 0.343782 0.94627 ] [ 0.020748 0.107017 0.719958 ] [ 0.127878 0.707388 0.615998 ] [ 0.286078 0.813431 0.995811 ] [ 0.713922 0.186569 0.004189 ] [ 0.872122 0.292612 0.384002 ] [ 0.529854 0.746576 0.935711 ] [ 0.2507 0.897308 0.641292 ] [ 0.878276 0.734453 0.669562 ] [ 0.803431 0.94539 0.102029 ] [ 0.13135 0.649815 0.97502 ] [ 0.164376 0.72369 0.44607 ] [ 0.271217 0.814524 0.159189 ] [ 0.734096 0.520408 0.304167 ] [ 0.265904 0.479592 0.695833 ] [ 0.728783 0.185476 0.840811 ] [ 0.835624 0.27631 0.55393 ] [ 0.86865 0.350185 0.02498 ] [ 0.196569 0.05461 0.897971 ] [ 0.121724 0.265547 0.330438 ] [ 0.7493 0.102692 0.358708 ] [ 0.470146 0.253424 0.064289 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "P" "P" "P" "P" "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" 5.9505529 "source-unit" "angstrom" } "b" { "source-value" 6.31360727 "source-unit" "angstrom" } "c" { "source-value" 9.43221471 "source-unit" "angstrom" } "alpha" { "source-value" 73.24257021 "source-unit" "degree" } "beta" { "source-value" 83.38109482 "source-unit" "degree" } "gamma" { "source-value" 80.38523111 "source-unit" "degree" } }