{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.913994 0.902916 0.982653 ] [ 0.913994 0.097084 0.482653 ] [ 0.413994 0.402916 0.982653 ] [ 0.413994 0.597084 0.482653 ] [ 0.40458 0.165467 0.307963 ] [ 0.40458 0.834533 0.807963 ] [ 0.90458 0.665467 0.307963 ] [ 0.90458 0.334533 0.807963 ] [ 0.475692 0.138899 0.699232 ] [ 0.475692 0.861101 0.199232 ] [ 0.975692 0.638899 0.699232 ] [ 0.975692 0.361101 0.199232 ] [ 0.178782 0.119875 0.682869 ] [ 0.5868 0.198589 0.535374 ] [ 0.071736 0.756555 0.83876 ] [ 0.626146 0.987087 0.744551 ] [ 0.178782 0.880125 0.182869 ] [ 0.5868 0.801411 0.035374 ] [ 0.071736 0.243445 0.33876 ] [ 0.626146 0.012913 0.244551 ] [ 0.678782 0.619875 0.682869 ] [ 0.0868 0.698589 0.535374 ] [ 0.571736 0.256555 0.83876 ] [ 0.126146 0.487087 0.744551 ] [ 0.678782 0.380125 0.182869 ] [ 0.0868 0.301411 0.035374 ] [ 0.571736 0.743445 0.33876 ] [ 0.126146 0.512913 0.244551 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Cu" "Cu" "Cu" "Cu" "P" "P" "P" "P" "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" 5.12578588 "source-unit" "angstrom" } "b" { "source-value" 8.89105004 "source-unit" "angstrom" } "c" { "source-value" 7.95378414 "source-unit" "angstrom" } "beta" { "source-value" 96.90629668 "source-unit" "degree" } }