{ "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" [ [ 0.768075 0.473551 0.167416 ] [ 0.231925 0.973551 0.832584 ] [ 0.217497 0.249504 0.336845 ] [ 0.782503 0.749504 0.663155 ] [ 0.270011 0.258914 0.069681 ] [ 0.729989 0.758914 0.930319 ] [ 0.271557 0.750139 0.422824 ] [ 0.728443 0.250139 0.577176 ] [ 0.684744 0.726813 0.061552 ] [ 0.039539 0.261495 0.126363 ] [ 0.460311 0.285958 0.179411 ] [ 0.211335 0.935101 0.328574 ] [ 0.173365 0.568493 0.33399 ] [ 0.861901 0.26149 0.434828 ] [ 0.555141 0.73069 0.458152 ] [ 0.444859 0.23069 0.541848 ] [ 0.138099 0.76149 0.565172 ] [ 0.826635 0.068493 0.66601 ] [ 0.788665 0.435101 0.671426 ] [ 0.539689 0.785958 0.820589 ] [ 0.960461 0.761495 0.873637 ] [ 0.315256 0.226813 0.938448 ] ] } "species" { "source-value" [ "Li" "Li" "V" "V" "C" "C" "S" "S" "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" 5.14875074 "source-unit" "angstrom" } "b" { "source-value" 6.42714922 "source-unit" "angstrom" } "c" { "source-value" 9.00126154 "source-unit" "angstrom" } "beta" { "source-value" 93.4093385 "source-unit" "degree" } }