{ "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" [ [ 0.258276 0.264938 0.201946 ] [ 0.333729 0.728531 0.589685 ] [ 0.666271 0.271469 0.410315 ] [ 0.741724 0.735062 0.798054 ] [ 0.112611 0.242786 0.586325 ] [ 0.427808 0.775468 0.197549 ] [ 0.145805 0.752774 0.965155 ] [ 0.854195 0.247226 0.034845 ] [ 0.572192 0.224532 0.802451 ] [ 0.887389 0.757214 0.413675 ] [ 0.157373 0.014034 0.655536 ] [ 0.166482 0.567725 0.120524 ] [ 0.03485 0.703691 0.554139 ] [ 0.343796 0.253805 0.43647 ] [ 0.066297 0.695327 0.831496 ] [ 0.592745 0.286708 0.149842 ] [ 0.348153 0.208095 0.948057 ] [ 0.358709 0.943832 0.306205 ] [ 0.516753 0.59306 0.351186 ] [ 0.483247 0.40694 0.648814 ] [ 0.641291 0.056168 0.693794 ] [ 0.651847 0.791905 0.051943 ] [ 0.407255 0.713292 0.850158 ] [ 0.933703 0.304673 0.168504 ] [ 0.656204 0.746195 0.56353 ] [ 0.96515 0.296309 0.445861 ] [ 0.833518 0.432275 0.879476 ] [ 0.842627 0.985966 0.344464 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Se" "Se" "Se" "Se" "Se" "Se" "O" "O" "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" 7.08100322 "source-unit" "angstrom" } "b" { "source-value" 8.1121474 "source-unit" "angstrom" } "c" { "source-value" 9.06207519 "source-unit" "angstrom" } "alpha" { "source-value" 71.5695859 "source-unit" "degree" } "beta" { "source-value" 70.14575915 "source-unit" "degree" } "gamma" { "source-value" 65.93790202 "source-unit" "degree" } }