{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.754935 0.247305 0.914989 ] [ 0.752651 0.501052 0.251453 ] [ 0.229113 0.020451 0.732772 ] [ 0.228476 0.480102 0.733692 ] [ 0.771046 0.980206 0.268272 ] [ 0.253661 0.763751 0.082926 ] [ 0.777125 0.748443 0.643392 ] [ 0.226106 0.244795 0.357277 ] [ 0.708446 0.244001 0.589277 ] [ 0.299972 0.753728 0.409948 ] [ 0.727359 0.758808 0.955282 ] [ 0.264069 0.247269 0.049143 ] [ 0.277379 0.250047 0.900396 ] [ 0.973232 0.752034 0.914053 ] [ 0.535253 0.746344 0.853115 ] [ 0.811229 0.063484 0.684329 ] [ 0.819997 0.433835 0.674551 ] [ 0.396579 0.24773 0.588074 ] [ 0.199097 0.752606 0.577314 ] [ 0.798775 0.232701 0.420922 ] [ 0.608993 0.77259 0.419405 ] [ 0.221303 0.560821 0.317194 ] [ 0.183303 0.929142 0.313475 ] [ 0.478854 0.242262 0.134228 ] [ 0.036357 0.249052 0.115511 ] [ 0.666689 0.777441 0.099009 ] ] } "species" { "source-value" [ "Na" "Na" "Li" "Li" "Li" "Li" "Mn" "Mn" "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" 5.03820482 "source-unit" "angstrom" } "b" { "source-value" 6.6477134 "source-unit" "angstrom" } "c" { "source-value" 8.74180173 "source-unit" "angstrom" } "alpha" { "source-value" 90.74326737 "source-unit" "degree" } "beta" { "source-value" 91.28151412 "source-unit" "degree" } "gamma" { "source-value" 90.27588021 "source-unit" "degree" } }