{ "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" [ [ 0.737343 0.880196 0.104202 ] [ 0.262657 0.119804 0.895798 ] [ 0.239578 0.342234 0.491018 ] [ 0.760422 0.657766 0.508982 ] [ 0.222827 0.709914 0.728421 ] [ 0.777173 0.290086 0.271579 ] [ 0.311629 0.936722 0.334544 ] [ 0.772802 0.35326 0.854251 ] [ 0.688371 0.063278 0.665456 ] [ 0.227198 0.64674 0.145749 ] [ 0.889572 0.875616 0.66525 ] [ 0.717823 0.279292 0.513958 ] [ 0.279351 0.883067 0.165575 ] [ 0.816733 0.287155 0.041965 ] [ 0.406423 0.99543 0.67652 ] [ 0.593577 0.00457 0.32348 ] [ 0.023847 0.432321 0.755248 ] [ 0.110428 0.124384 0.33475 ] [ 0.536488 0.509093 0.785309 ] [ 0.463512 0.490907 0.214691 ] [ 0.282177 0.720708 0.486042 ] [ 0.183267 0.712845 0.958035 ] [ 0.976153 0.567679 0.244752 ] [ 0.720649 0.116933 0.834425 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Zr" "Zr" "Si" "Si" "Si" "Si" "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" 5.52997288188 "source-unit" "angstrom" } "b" { "source-value" 6.67475711122 "source-unit" "angstrom" } "c" { "source-value" 9.00019814619 "source-unit" "angstrom" } "alpha" { "source-value" 70.8475245051 "source-unit" "degree" } "beta" { "source-value" 87.6945692402 "source-unit" "degree" } "gamma" { "source-value" 86.0115231707 "source-unit" "degree" } }