{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.543888 0.458424 0.732027 ] [ 0.456112 0.541576 0.267973 ] [ 0 1 0.5 ] [ 0.695445 0.760896 0.138229 ] [ 0.916494 0.078167 0.748602 ] [ 0.083506 0.921833 0.251398 ] [ 0.235001 0.325639 0.357211 ] [ 0.311903 0.700198 0.533993 ] [ 0.295619 0.691302 0.965856 ] [ 0.304555 0.239104 0.861771 ] [ 0.688097 0.299802 0.466007 ] [ 0.764999 0.674361 0.642789 ] [ 0.704381 0.308698 0.034144 ] ] } "species" { "source-value" [ "U" "U" "U" "Cu" "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" 5.61641082441 "source-unit" "angstrom" } "b" { "source-value" 5.66431349557 "source-unit" "angstrom" } "c" { "source-value" 7.59280198567 "source-unit" "angstrom" } "alpha" { "source-value" 71.0468763754 "source-unit" "degree" } "beta" { "source-value" 70.2039090586 "source-unit" "degree" } "gamma" { "source-value" 71.2627069502 "source-unit" "degree" } }