{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.799765 0.212078 0.348813 ] [ 0.200235 0.712078 0.651187 ] [ 0.197057 0.058044 0.729399 ] [ 0.802943 0.558044 0.270601 ] [ 0.785504 0.261533 0.922525 ] [ 0.214496 0.761533 0.077475 ] [ 0.587784 0.881969 0.439392 ] [ 0.412216 0.381969 0.560608 ] [ 0.592329 0.382594 0.780979 ] [ 0.067057 0.25372 0.884991 ] [ 0.932943 0.75372 0.115009 ] [ 0.803215 0.317884 0.118617 ] [ 0.776713 0.743309 0.477658 ] [ 0.757225 0.024456 0.464022 ] [ 0.615502 0.37734 0.443138 ] [ 0.223287 0.243309 0.522342 ] [ 0.407671 0.882594 0.219021 ] [ 0.361225 0.610418 0.118956 ] [ 0.638775 0.110418 0.881044 ] [ 0.384498 0.87734 0.556862 ] [ 0.242775 0.524456 0.535978 ] [ 0.196785 0.817884 0.881383 ] ] } "species" { "source-value" [ "Li" "Li" "Bi" "Bi" "P" "P" "P" "P" "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" 5.03834563254 "source-unit" "angstrom" } "b" { "source-value" 9.07576149 "source-unit" "angstrom" } "c" { "source-value" 7.45530711754 "source-unit" "angstrom" } "beta" { "source-value" 107.30540653 "source-unit" "degree" } }