{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.14658 0.25 ] [ 0 0.85342 0.75 ] [ 0.5 0.078202 0.886877 ] [ 0.5 0.921798 0.113123 ] [ 0.5 0.921798 0.386877 ] [ 0.5 0.078202 0.613123 ] [ 0.5 0.64658 0.25 ] [ 0.5 0.35342 0.75 ] [ 0 0.578202 0.886877 ] [ 0 0.421798 0.113123 ] [ 0 0.421798 0.386877 ] [ 0 0.578202 0.613123 ] [ 0 0.836067 0.25 ] [ 0 0.163933 0.75 ] [ 0 0.884326 0.540562 ] [ 0 0.115674 0.459438 ] [ 0 0.115674 0.040562 ] [ 0 0.884326 0.959438 ] [ 0.5 0.336067 0.25 ] [ 0.5 0.663933 0.75 ] [ 0.5 0.384326 0.540562 ] [ 0.5 0.615674 0.459438 ] [ 0.5 0.615674 0.040562 ] [ 0.5 0.384326 0.959438 ] [ 0.5 0.786668 0.582671 ] [ 0.5 0.213332 0.417329 ] [ 0.5 0.213332 0.082671 ] [ 0.5 0.786668 0.917329 ] [ 0 0.286668 0.582671 ] [ 0 0.713332 0.417329 ] [ 0 0.713332 0.082671 ] [ 0 0.286668 0.917329 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.26263739 "source-unit" "angstrom" } "b" { "source-value" 10.81906036 "source-unit" "angstrom" } "c" { "source-value" 13.92064598 "source-unit" "angstrom" } }