{ "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 0.06971 0.674162 ] [ 0.25 0.93029 0.325838 ] [ 0.75 0.56971 0.825838 ] [ 0.25 0.43029 0.174162 ] [ 0.75 0.335084 0.444105 ] [ 0.25 0.664916 0.555895 ] [ 0.75 0.835084 0.055895 ] [ 0.25 0.164916 0.944105 ] [ 0.75 0.476394 0.597596 ] [ 0.75 0.82628 0.496232 ] [ 0.25 0.67372 0.996232 ] [ 0.75 0.32628 0.003768 ] [ 0.25 0.281674 0.793522 ] [ 0.75 0.718326 0.206478 ] [ 0.25 0.781674 0.706478 ] [ 0.25 0.523606 0.402404 ] [ 0.75 0.976394 0.902404 ] [ 0.25 0.023606 0.097596 ] [ 0.75 0.218326 0.293522 ] [ 0.25 0.17372 0.503768 ] ] } "species" { "source-value" [ "Rb" "Rb" "Rb" "Rb" "Cd" "Cd" "Cd" "Cd" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.11940023 "source-unit" "angstrom" } "b" { "source-value" 9.21228274 "source-unit" "angstrom" } "c" { "source-value" 15.31262964 "source-unit" "angstrom" } }