{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pnam" } "basis-atom-coordinates" { "source-value" [ [ 0.765319 0.234691 0.983989 ] [ 0.234681 0.765309 0.483989 ] [ 0.998914 0.531394 0.75 ] [ 0.265319 0.265309 0.983989 ] [ 0.234681 0.765309 0.016011 ] [ 0.265319 0.265309 0.516011 ] [ 0.001086 0.468606 0.25 ] [ 0.498914 0.968606 0.75 ] [ 0.501086 0.031394 0.25 ] [ 0.765319 0.234691 0.516011 ] [ 0.734681 0.734691 0.483989 ] [ 0.734681 0.734691 0.016011 ] [ 0.506248 0.498993 0.75 ] [ 0.993752 0.998993 0.25 ] [ 0.493752 0.501007 0.25 ] [ 0.006248 0.001007 0.75 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Si" "Si" "Si" "Si" "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" 6.57434739 "source-unit" "angstrom" } "b" { "source-value" 6.58953254 "source-unit" "angstrom" } "c" { "source-value" 9.30522979 "source-unit" "angstrom" } }