{ "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" [ [ 0.482231 0.480543 0.006598 ] [ 0.452582 0.820343 0.348071 ] [ 0.521527 0.163462 0.668519 ] [ 0.996516 0.627319 0.728773 ] [ 0.948311 0.337956 0.287034 ] [ 0.898098 0.942533 0.015231 ] [ 0.496681 0.338596 0.821725 ] [ 0.517809 0.665083 0.17874 ] [ 0.496794 0.990195 0.505318 ] [ 0.503589 0.841776 0.829461 ] [ 0.49668 0.491548 0.500047 ] [ 0.515352 0.147535 0.183556 ] [ 0.994135 0.162481 0.667975 ] [ 0.99449 0.825492 0.337717 ] [ 0.988625 0.517549 0.004134 ] ] } "species" { "source-value" [ "Mg" "Nb" "Nb" "Pb" "Pb" "Pb" "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" 4.12712504 "source-unit" "angstrom" } "b" { "source-value" 5.78465435 "source-unit" "angstrom" } "c" { "source-value" 9.21080872 "source-unit" "angstrom" } "alpha" { "source-value" 71.89390573 "source-unit" "degree" } "beta" { "source-value" 89.4306718 "source-unit" "degree" } "gamma" { "source-value" 89.65032785 "source-unit" "degree" } }