{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2" } "basis-atom-coordinates" { "source-value" [ [ 0.475526 0.469212 0.755958 ] [ 0.524474 0.469212 0.244042 ] [ 0.965233 0.97137 0.758819 ] [ 0.034767 0.97137 0.241181 ] [ 0.296113 0.217712 0.793792 ] [ 0.703887 0.217712 0.206208 ] [ 0.293696 0.805757 0.288241 ] [ 0.706304 0.805757 0.711759 ] [ 0 0.922384 0 ] [ 0 0.087197 0.5 ] [ 0.197407 0.305537 0.202454 ] [ 0.802593 0.305537 0.797546 ] [ 0.5 0.410307 0.5 ] [ 0.5 0.610222 0 ] [ 0.204841 0.715357 0.696461 ] [ 0.795159 0.715357 0.303539 ] ] } "species" { "source-value" [ "V" "V" "V" "V" "O" "O" "O" "O" "O" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.41679159 "source-unit" "angstrom" } "b" { "source-value" 5.18995835 "source-unit" "angstrom" } "c" { "source-value" 7.44387926 "source-unit" "angstrom" } "beta" { "source-value" 92.99509369 "source-unit" "degree" } }