{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcb" } "basis-atom-coordinates" { "source-value" [ [ 0 0.256412 0.542214 ] [ 0 0.743588 0.457786 ] [ 0 0.756412 0.957786 ] [ 0 0.243588 0.042214 ] [ 0.5 0.105567 0.803623 ] [ 0.5 0.894433 0.196377 ] [ 0.5 0.605567 0.696377 ] [ 0.5 0.394433 0.303623 ] [ 0.5 0.5 0.5 ] [ 0.5 0 0 ] [ 0 0.35884 0.734912 ] [ 0 0.64116 0.265088 ] [ 0 0.85884 0.765088 ] [ 0 0.14116 0.234912 ] [ 0 0.401991 0.844434 ] [ 0 0.598009 0.155566 ] [ 0 0.098009 0.344434 ] [ 0 0.901991 0.655566 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "C" "C" "C" "C" "C" "C" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.64409689 "source-unit" "angstrom" } "b" { "source-value" 6.54623749 "source-unit" "angstrom" } "c" { "source-value" 11.91544767 "source-unit" "angstrom" } }