{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.146407 0.93194 0.253504 ] [ 0.722286 0.639225 0.878213 ] [ 0.277714 0.139225 0.621787 ] [ 0.853593 0.43194 0.246496 ] [ 0.146407 0.56806 0.753504 ] [ 0.722286 0.860775 0.378213 ] [ 0.277714 0.360775 0.121787 ] [ 0.853593 0.06806 0.746496 ] [ 0.406184 0.574357 0.520732 ] [ 0.593816 0.074357 0.979268 ] [ 0.406184 0.925643 0.020732 ] [ 0.593816 0.425643 0.479268 ] [ 0.341427 0.379141 0.409896 ] [ 0.729761 0.177574 0.947221 ] [ 0.270239 0.677574 0.552779 ] [ 0.658573 0.879141 0.090104 ] [ 0.341427 0.120859 0.909896 ] [ 0.729761 0.322426 0.447221 ] [ 0.270239 0.822426 0.052779 ] [ 0.658573 0.620859 0.590104 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Be" "Be" "Be" "Be" "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" 7.98043368 "source-unit" "angstrom" } "b" { "source-value" 6.29741287 "source-unit" "angstrom" } "c" { "source-value" 11.89250485 "source-unit" "angstrom" } "beta" { "source-value" 132.01863364 "source-unit" "degree" } }