{ "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" [ [ 0.232528 0.210386 0.855921 ] [ 0.767472 0.789614 0.144079 ] [ 0.733979 0.371984 0.602617 ] [ 0.266021 0.628016 0.397383 ] [ 0.800543 0.318541 0.143689 ] [ 0.199457 0.681459 0.856311 ] [ 0.837204 0.879423 0.669204 ] [ 0.162796 0.120577 0.330796 ] [ 0.273781 0.906887 0.318863 ] [ 0.726219 0.093113 0.681137 ] [ 0.235515 0.303953 0.446626 ] [ 0.764485 0.696047 0.553374 ] [ 0.933666 0.138644 0.200699 ] [ 0.066334 0.861356 0.799301 ] [ 0.26796 0.725178 0.004301 ] [ 0.73204 0.274822 0.995699 ] [ 0.759263 0.52328 0.241522 ] [ 0.240737 0.47672 0.758478 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "B" "B" "B" "B" "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" 3.16027108952 "source-unit" "angstrom" } "b" { "source-value" 6.21755828198 "source-unit" "angstrom" } "c" { "source-value" 9.31315873487 "source-unit" "angstrom" } "alpha" { "source-value" 104.579858939 "source-unit" "degree" } "beta" { "source-value" 90.595176987 "source-unit" "degree" } "gamma" { "source-value" 91.8867721655 "source-unit" "degree" } }