{ "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" [ [ 0.340999 0.319302 0.90224 ] [ 0.994918 0.005416 0.989032 ] [ 0.992555 0.013051 0.487754 ] [ 0.670683 0.662213 0.40304 ] [ 0.165987 0.667143 0.210121 ] [ 0.338456 0.829219 0.711963 ] [ 0.832247 0.82892 0.711973 ] [ 0.171759 0.174459 0.213554 ] [ 0.649729 0.174555 0.217461 ] [ 0.829222 0.341072 0.717175 ] [ 0.331185 0.337377 0.488233 ] [ 0.667641 0.661857 0.988087 ] [ 0.159655 0.179104 0.592309 ] [ 0.49136 0.034396 0.344901 ] [ 0.361674 0.307725 0.106315 ] [ 0.976244 0.027963 0.300258 ] [ 0.000362 0.998863 0.79959 ] [ 0.660264 0.18083 0.593321 ] [ 0.040278 0.466619 0.348646 ] [ 0.495751 0.466038 0.34929 ] [ 0.826547 0.338352 0.09844 ] [ 0.159895 0.679729 0.590241 ] [ 0.526584 0.501363 0.852278 ] [ 0.972054 0.499396 0.853437 ] [ 0.668086 0.663739 0.615116 ] [ 0.328879 0.846925 0.089697 ] [ 0.525596 0.949292 0.842666 ] [ 0.821088 0.845082 0.090701 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "V" "V" "V" "Sb" "Sb" "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" 5.9363702 "source-unit" "angstrom" } "b" { "source-value" 6.068612 "source-unit" "angstrom" } "c" { "source-value" 9.79082308 "source-unit" "angstrom" } "alpha" { "source-value" 91.67736155 "source-unit" "degree" } "beta" { "source-value" 89.93457621 "source-unit" "degree" } "gamma" { "source-value" 119.28604876 "source-unit" "degree" } }