{ "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" [ [ 0.194074 0.386542 0.847802 ] [ 0.805926 0.613458 0.152198 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.495175 0.838592 0.353839 ] [ 0.504825 0.161408 0.646161 ] [ 0.149775 0.232072 0.174931 ] [ 0.850225 0.767928 0.825069 ] [ 0.58298 0.707636 0.905862 ] [ 0.13705 0.791744 0.957005 ] [ 0.41702 0.292364 0.094138 ] [ 0.324763 0.83666 0.536156 ] [ 0.560739 0.8702 0.176626 ] [ 0.86295 0.208256 0.042995 ] [ 0.161207 0.510508 0.288439 ] [ 0.866621 0.019809 0.734715 ] [ 0.279801 0.333985 0.590585 ] [ 0.838793 0.489492 0.711561 ] [ 0.439261 0.1298 0.823374 ] [ 0.720199 0.666015 0.409415 ] [ 0.675237 0.16334 0.463844 ] [ 0.133379 0.980191 0.265285 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Al" "Mo" "Mo" "As" "As" "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" 5.28278638058 "source-unit" "angstrom" } "b" { "source-value" 5.49119680361 "source-unit" "angstrom" } "c" { "source-value" 9.58569131222 "source-unit" "angstrom" } "alpha" { "source-value" 96.31429456 "source-unit" "degree" } "beta" { "source-value" 102.343742609 "source-unit" "degree" } "gamma" { "source-value" 105.169986237 "source-unit" "degree" } }