{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.012881 0.297266 ] [ 0.25 0.987119 0.702734 ] [ 0.75 0.512881 0.202734 ] [ 0.25 0.487119 0.797266 ] [ 0.75 0.799328 0.915083 ] [ 0.25 0.200672 0.084917 ] [ 0.75 0.299328 0.584917 ] [ 0.25 0.700672 0.415083 ] [ 0.75 0.690612 0.58664 ] [ 0.25 0.309388 0.41336 ] [ 0.75 0.190612 0.91336 ] [ 0.25 0.809388 0.08664 ] ] } "species" { "source-value" [ "Dy" "Dy" "Dy" "Dy" "Ni" "Ni" "Ni" "Ni" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.47766674 "source-unit" "angstrom" } "b" { "source-value" 7.13285633 "source-unit" "angstrom" } "c" { "source-value" 7.69137049 "source-unit" "angstrom" } }