{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.499579 0.719994 0.99708 ] [ 0.999579 0.280006 0.49708 ] [ 0.510145 0.306414 0.252382 ] [ 0.010145 0.693586 0.752382 ] [ 0.985573 0.818504 0.252742 ] [ 0.485573 0.181496 0.752742 ] [ 0.000162 0.260003 0.000643 ] [ 0.500162 0.739997 0.500643 ] [ 0.903744 0.291011 0.760187 ] [ 0.826499 0.541803 0.049904 ] [ 0.789074 0.56486 0.453477 ] [ 0.71367 0.077487 0.045759 ] [ 0.67683 0.023258 0.447245 ] [ 0.594724 0.777222 0.740581 ] [ 0.403744 0.708989 0.260187 ] [ 0.326499 0.458197 0.549904 ] [ 0.289074 0.43514 0.953477 ] [ 0.21367 0.922513 0.545759 ] [ 0.17683 0.976742 0.947245 ] [ 0.094724 0.222778 0.240581 ] ] } "species" { "source-value" [ "Li" "Li" "Ca" "Ca" "Pr" "Pr" "Te" "Te" "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" 5.5671250022 "source-unit" "angstrom" } "b" { "source-value" 5.84494312 "source-unit" "angstrom" } "c" { "source-value" 7.79177237214 "source-unit" "angstrom" } "beta" { "source-value" 90.6709033103 "source-unit" "degree" } }