{ "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" [ [ 0.767911 0.25 0.903812 ] [ 0.232089 0.75 0.096188 ] [ 0.796931 0.75 0.677533 ] [ 0.203069 0.25 0.322467 ] [ 0.742038 0.25 0.574332 ] [ 0.257962 0.75 0.425668 ] [ 0.686284 0.75 0.958516 ] [ 0.313716 0.25 0.041484 ] [ 0.927428 0.75 0.92329 ] [ 0.38479 0.25 0.903182 ] [ 0.526669 0.75 0.822121 ] [ 0.800136 0.061574 0.689082 ] [ 0.800136 0.438426 0.689082 ] [ 0.090302 0.75 0.568927 ] [ 0.460528 0.25 0.501374 ] [ 0.539472 0.75 0.498626 ] [ 0.909698 0.25 0.431073 ] [ 0.199864 0.561574 0.310918 ] [ 0.199864 0.938426 0.310918 ] [ 0.473331 0.25 0.177879 ] [ 0.61521 0.75 0.096818 ] [ 0.072572 0.25 0.07671 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "P" "P" "C" "C" "O" "O" "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" 5.26553834 "source-unit" "angstrom" } "b" { "source-value" 6.41506963 "source-unit" "angstrom" } "c" { "source-value" 8.24408227 "source-unit" "angstrom" } "beta" { "source-value" 96.31127396 "source-unit" "degree" } }