{ "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" [ [ 0.676497 0.636991 0.249714 ] [ 0.323339 0.137201 0.249968 ] [ 0.676661 0.637201 0.750032 ] [ 0.323503 0.136991 0.750286 ] [ 0.729306 0.000365 0.256503 ] [ 0.270694 0.500365 0.743497 ] [ 0.272166 0.499917 0.243243 ] [ 0.727834 0.999917 0.756757 ] [ 0.914226 0.217213 0.062793 ] [ 0.521549 0.320251 0.061286 ] [ 0.477114 0.819413 0.439102 ] [ 0.913961 0.215087 0.564099 ] [ 0.086039 0.715087 0.435901 ] [ 0.522886 0.319413 0.560898 ] [ 0.478451 0.820251 0.938714 ] [ 0.085774 0.717213 0.937207 ] [ 0.752902 0.348435 0.079421 ] [ 0.919577 0.066707 0.15787 ] [ 0.605832 0.82176 0.104277 ] [ 0.504773 0.155761 0.128952 ] [ 0.481331 0.463212 0.147657 ] [ 0.145481 0.676809 0.099586 ] [ 0.115362 0.307465 0.123617 ] [ 0.884444 0.802556 0.37723 ] [ 0.851005 0.176437 0.400601 ] [ 0.517508 0.961467 0.351744 ] [ 0.490112 0.653775 0.369743 ] [ 0.393458 0.320219 0.396338 ] [ 0.08428 0.565062 0.341952 ] [ 0.24609 0.848316 0.420677 ] [ 0.75391 0.348316 0.579323 ] [ 0.91572 0.065062 0.658048 ] [ 0.606542 0.820219 0.603662 ] [ 0.509888 0.153775 0.630257 ] [ 0.482492 0.461467 0.648256 ] [ 0.148995 0.676437 0.599399 ] [ 0.115556 0.302556 0.62277 ] [ 0.884638 0.807465 0.876383 ] [ 0.854519 0.176809 0.900414 ] [ 0.518669 0.963212 0.852343 ] [ 0.495227 0.655761 0.871048 ] [ 0.394168 0.32176 0.895723 ] [ 0.080423 0.566707 0.84213 ] [ 0.247098 0.848435 0.920579 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "V" "V" "Cr" "Cr" "P" "P" "P" "P" "P" "P" "P" "P" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "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" 7.15127676 "source-unit" "angstrom" } "b" { "source-value" 8.22140472 "source-unit" "angstrom" } "c" { "source-value" 9.74233852 "source-unit" "angstrom" } "beta" { "source-value" 111.46355376 "source-unit" "degree" } }