{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0.187864 0.93006 0.899243 ] [ 0.299962 0.068812 0.24494 ] [ 0.376193 0.772228 0.558575 ] [ 0.623807 0.227772 0.441425 ] [ 0.700038 0.931188 0.75506 ] [ 0.812136 0.06994 0.100757 ] [ 0.098359 0.582602 0.229965 ] [ 0.901641 0.417398 0.770035 ] [ 0.165727 0.171549 0.558475 ] [ 0.345296 0.333836 0.875425 ] [ 0.654704 0.666164 0.124575 ] [ 0.834273 0.828451 0.441525 ] [ 0.080581 0.81282 0.372579 ] [ 0.2531 0.501299 0.724083 ] [ 0.145812 0.208878 0.982214 ] [ 0.237467 0.296854 0.378016 ] [ 0.351111 0.027346 0.660324 ] [ 0.399582 0.70986 0.084136 ] [ 0.600418 0.29014 0.915864 ] [ 0.648889 0.972654 0.339676 ] [ 0.762533 0.703146 0.621984 ] [ 0.854188 0.791122 0.017786 ] [ 0.7469 0.498701 0.275917 ] [ 0.919419 0.18718 0.627421 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Mn" "Mn" "B" "B" "B" "B" "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" 5.17055232 "source-unit" "angstrom" } "b" { "source-value" 6.38517775 "source-unit" "angstrom" } "c" { "source-value" 7.76374667 "source-unit" "angstrom" } "alpha" { "source-value" 70.65049389 "source-unit" "degree" } "beta" { "source-value" 89.4265713 "source-unit" "degree" } "gamma" { "source-value" 88.42641873 "source-unit" "degree" } }