{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.003343 0.20552 0.169242 ] [ 0.003343 0.29448 0.669242 ] [ 0.228679 0.305459 0.426789 ] [ 0.228679 0.194541 0.926789 ] [ 0.771321 0.805459 0.073211 ] [ 0.771321 0.694541 0.573211 ] [ 0.996657 0.70552 0.330758 ] [ 0.996657 0.79448 0.830758 ] [ 0.49996 0.205623 0.16267 ] [ 0.50004 0.705623 0.33733 ] [ 0.49996 0.294377 0.66267 ] [ 0.50004 0.794377 0.83733 ] [ 0.246873 0.700303 0.087288 ] [ 0.246873 0.799697 0.587288 ] [ 0.753127 0.200303 0.412712 ] [ 0.753127 0.299697 0.912712 ] [ 0.044081 0.814836 0.158927 ] [ 0.044081 0.685164 0.658927 ] [ 0.252056 0.377287 0.09109 ] [ 0.251879 0.701547 0.442268 ] [ 0.252056 0.122713 0.59109 ] [ 0.469384 0.805656 0.158347 ] [ 0.251879 0.798453 0.942268 ] [ 0.469384 0.694344 0.658347 ] [ 0.530616 0.305656 0.341653 ] [ 0.748121 0.201547 0.057732 ] [ 0.530616 0.194344 0.841653 ] [ 0.747944 0.877287 0.40891 ] [ 0.748121 0.298453 0.557732 ] [ 0.747944 0.622713 0.90891 ] [ 0.955919 0.314836 0.341073 ] [ 0.955919 0.185164 0.841073 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "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" 6.36709436 "source-unit" "angstrom" } "b" { "source-value" 5.12997788 "source-unit" "angstrom" } "c" { "source-value" 10.78860198 "source-unit" "angstrom" } "beta" { "source-value" 90.65917277 "source-unit" "degree" } }