{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.5 ] [ 0 0.5 0.5 ] [ 0.386474 0.75 0.245998 ] [ 0.613526 0.25 0.754002 ] [ 0.497237 0.25 0.256292 ] [ 0.502763 0.75 0.743708 ] [ 0.679205 0.25 0.027673 ] [ 0.727992 0.75 0.285638 ] [ 0.276486 0.470279 0.271295 ] [ 0.276486 0.029721 0.271295 ] [ 0.752588 0.25 0.459801 ] [ 0.247412 0.75 0.540199 ] [ 0.723514 0.970279 0.728705 ] [ 0.723514 0.529721 0.728705 ] [ 0.272008 0.25 0.714362 ] [ 0.320795 0.75 0.972327 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "Ge" "Ge" "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" 4.76175774 "source-unit" "angstrom" } "b" { "source-value" 6.46030391 "source-unit" "angstrom" } "c" { "source-value" 6.57267181 "source-unit" "angstrom" } "beta" { "source-value" 92.69183201 "source-unit" "degree" } }