{ "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" [ [ 0.338672 0.328369 0.901299 ] [ 0.993467 0.998038 0.995413 ] [ 0.993871 0.996851 0.494449 ] [ 0.667018 0.670623 0.397887 ] [ 0.328575 0.341603 0.483654 ] [ 0.672523 0.661743 0.985809 ] [ 0.171227 0.1651 0.210894 ] [ 0.825999 0.339315 0.713086 ] [ 0.336611 0.832365 0.71354 ] [ 0.659333 0.169471 0.213547 ] [ 0.168386 0.657532 0.214326 ] [ 0.826377 0.829956 0.713495 ] [ 0.667529 0.166984 0.600155 ] [ 0.479818 0.481544 0.335849 ] [ 0.338772 0.349134 0.110162 ] [ 0.996118 0.98492 0.304288 ] [ 0.985034 0.003827 0.806875 ] [ 0.161629 0.668016 0.597136 ] [ 0.484942 0.042832 0.344528 ] [ 0.039318 0.497102 0.343046 ] [ 0.83786 0.832677 0.101209 ] [ 0.157461 0.17459 0.596041 ] [ 0.962651 0.522354 0.838091 ] [ 0.528583 0.958218 0.846987 ] [ 0.678267 0.660378 0.606177 ] [ 0.833676 0.332198 0.097863 ] [ 0.53234 0.509164 0.846673 ] [ 0.334247 0.824795 0.09536 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Fe" "Fe" "Fe" "Co" "Co" "Co" "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" 5.78383155 "source-unit" "angstrom" } "b" { "source-value" 5.78653337 "source-unit" "angstrom" } "c" { "source-value" 9.37990564 "source-unit" "angstrom" } "alpha" { "source-value" 89.54991895 "source-unit" "degree" } "beta" { "source-value" 89.28407322 "source-unit" "degree" } "gamma" { "source-value" 60.04492092 "source-unit" "degree" } }