{ "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" [ [ 0.25 0.468586 0.819395 ] [ 0.25 0.968586 0.680605 ] [ 0.75 0.531414 0.180605 ] [ 0.75 0.031414 0.319395 ] [ 0.75 0.240747 0.617985 ] [ 0.25 0.259253 0.117985 ] [ 0.75 0.740747 0.882015 ] [ 0.25 0.759253 0.382015 ] [ 0.25 0.354883 0.43664 ] [ 0.25 0.854883 0.06336 ] [ 0.75 0.145117 0.93664 ] [ 0.75 0.645117 0.56336 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "As" "As" "As" "As" "Rh" "Rh" "Rh" "Rh" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.91063313 "source-unit" "angstrom" } "b" { "source-value" 6.14269712 "source-unit" "angstrom" } "c" { "source-value" 7.30970581 "source-unit" "angstrom" } }