{ "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" [ [ 0.398902 0.796976 0.123865 ] [ 0.601098 0.203024 0.876135 ] [ 0.728861 0.759044 0.691277 ] [ 0.271139 0.240956 0.308723 ] [ 0.254334 0.707939 0.670134 ] [ 0.880384 0.705754 0.14514 ] [ 0.119616 0.294246 0.85486 ] [ 0.745666 0.292061 0.329866 ] [ 0.200176 0.048656 0.681297 ] [ 0.799824 0.951344 0.318703 ] [ 0.081303 0.822275 0.614231 ] [ 0.118508 0.887232 0.171057 ] [ 0.439903 0.837413 0.843291 ] [ 0.37765 0.653187 0.508245 ] [ 0.710127 0.786029 0.251897 ] [ 0.086178 0.483374 0.736177 ] [ 0.232951 0.399832 0.060551 ] [ 0.767049 0.600168 0.939449 ] [ 0.913822 0.516626 0.263823 ] [ 0.289873 0.213971 0.748103 ] [ 0.62235 0.346813 0.491755 ] [ 0.560097 0.162587 0.156709 ] [ 0.881492 0.112768 0.828943 ] [ 0.918697 0.177725 0.385769 ] ] } "species" { "source-value" [ "Li" "Li" "Mn" "Mn" "P" "P" "P" "P" "H" "H" "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" 6.26516046 "source-unit" "angstrom" } "b" { "source-value" 6.5409723 "source-unit" "angstrom" } "c" { "source-value" 7.00246608 "source-unit" "angstrom" } "alpha" { "source-value" 94.17369833 "source-unit" "degree" } "beta" { "source-value" 96.91475139 "source-unit" "degree" } "gamma" { "source-value" 110.86827589 "source-unit" "degree" } }