{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.225473 0 0.116223 ] [ 0.774527 0 0.883777 ] [ 0.725473 0.5 0.116223 ] [ 0.274527 0.5 0.883777 ] [ 0.363719 0 0.73309 ] [ 0.636281 0 0.26691 ] [ 0.863719 0.5 0.73309 ] [ 0.136281 0.5 0.26691 ] [ 0.98931 0 0.238331 ] [ 0.01069 0 0.761669 ] [ 0.48931 0.5 0.238331 ] [ 0.51069 0.5 0.761669 ] [ 0.303958 0.187107 0.846555 ] [ 0.461419 0 0.206068 ] [ 0.303958 0.812893 0.846555 ] [ 0.294108 0 0.469807 ] [ 0.696042 0.812893 0.153445 ] [ 0.696042 0.187107 0.153445 ] [ 0.705892 0 0.530193 ] [ 0.538581 0 0.793932 ] [ 0.803958 0.687107 0.846555 ] [ 0.961419 0.5 0.206068 ] [ 0.803958 0.312893 0.846555 ] [ 0.794108 0.5 0.469807 ] [ 0.196042 0.312893 0.153445 ] [ 0.196042 0.687107 0.153445 ] [ 0.205892 0.5 0.530193 ] [ 0.038581 0.5 0.793932 ] ] } "species" { "source-value" [ "Eu" "Eu" "Eu" "Eu" "Mo" "Mo" "Mo" "Mo" "Cl" "Cl" "Cl" "Cl" "O" "O" "O" "O" "O" "O" "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" 10.614907681 "source-unit" "angstrom" } "b" { "source-value" 7.50928613661 "source-unit" "angstrom" } "c" { "source-value" 6.98217299427 "source-unit" "angstrom" } "beta" { "source-value" 106.708116983 "source-unit" "degree" } }