{ "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" [ [ 0.681111 0.362545 0.914461 ] [ 0.193883 0.441808 0.772381 ] [ 0.806117 0.558192 0.227619 ] [ 0.318889 0.637455 0.085539 ] [ 0.305565 0.934098 0.779929 ] [ 0.780958 0.160723 0.588637 ] [ 0.219042 0.839277 0.411363 ] [ 0.694435 0.065902 0.220071 ] [ 0.814759 0.839577 0.908069 ] [ 0.679284 0.709968 0.537549 ] [ 0.320716 0.290032 0.462451 ] [ 0.185241 0.160423 0.091931 ] [ 0.611073 0.704413 0.885106 ] [ 0.102889 0.7071 0.877183 ] [ 0.224799 0.134625 0.916688 ] [ 0.787355 0.093181 0.80302 ] [ 0.866486 0.851725 0.572533 ] [ 0.389837 0.777603 0.609356 ] [ 0.790623 0.452111 0.602222 ] [ 0.356544 0.225143 0.640537 ] [ 0.643456 0.774857 0.359463 ] [ 0.209377 0.547889 0.397778 ] [ 0.610163 0.222397 0.390644 ] [ 0.133514 0.148275 0.427467 ] [ 0.212645 0.906819 0.19698 ] [ 0.775201 0.865375 0.083312 ] [ 0.897111 0.2929 0.122816 ] [ 0.388927 0.295587 0.114894 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Mn" "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" 5.71167901 "source-unit" "angstrom" } "b" { "source-value" 6.19627914 "source-unit" "angstrom" } "c" { "source-value" 9.27744019 "source-unit" "angstrom" } "alpha" { "source-value" 78.05129773 "source-unit" "degree" } "beta" { "source-value" 81.18125017 "source-unit" "degree" } "gamma" { "source-value" 76.49833768 "source-unit" "degree" } }