{ "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" [ [ 0.762111 0.764364 0.17405 ] [ 0.762111 0.235636 0.67405 ] [ 0.259746 0.243025 0.326235 ] [ 0.256498 0.495579 0.093299 ] [ 0.256498 0.504421 0.593299 ] [ 0.259746 0.756975 0.826235 ] [ 0.259731 0.99424 0.578043 ] [ 0.259731 0.00576 0.078043 ] [ 0.762466 0.48745 0.914029 ] [ 0.762466 0.51255 0.414029 ] [ 0.262955 0.75592 0.330927 ] [ 0.262955 0.24408 0.830927 ] [ 0.765728 0.256382 0.168824 ] [ 0.765728 0.743618 0.668824 ] [ 0.153744 0.746889 0.189621 ] [ 0.58783 0.728684 0.33096 ] [ 0.643774 0.961152 0.613735 ] [ 0.185904 0.974391 0.401412 ] [ 0.185904 0.025609 0.901412 ] [ 0.643774 0.038848 0.113735 ] [ 0.58783 0.271316 0.83096 ] [ 0.153744 0.253111 0.689621 ] [ 0.653428 0.290367 0.309548 ] [ 0.088299 0.255948 0.168326 ] [ 0.143321 0.459048 0.906073 ] [ 0.663385 0.467934 0.084587 ] [ 0.663385 0.532066 0.584587 ] [ 0.143321 0.540952 0.406073 ] [ 0.088299 0.744052 0.668326 ] [ 0.653428 0.709633 0.809548 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Fe" "Fe" "Fe" "Fe" "Si" "Si" "Si" "Si" "O" "O" "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" 5.06805205 "source-unit" "angstrom" } "b" { "source-value" 6.32692712 "source-unit" "angstrom" } "c" { "source-value" 10.96495116 "source-unit" "angstrom" } "beta" { "source-value" 90.04627684 "source-unit" "degree" } }