{ "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" [ [ 0.201949 0.702468 0.01088 ] [ 0.72085 0.209341 0.477814 ] [ 0.798051 0.297532 0.98912 ] [ 0.659751 0.830508 0.167292 ] [ 0.340249 0.169492 0.832708 ] [ 0.27915 0.790659 0.522186 ] [ 0.778852 0.736504 0.722418 ] [ 0.221148 0.263496 0.277582 ] [ 0 0.5 0.5 ] [ 0.008323 0.470037 0.264033 ] [ 0.76609 0.743692 0.513982 ] [ 0.991677 0.529963 0.735967 ] [ 0.42099 0.296903 0.188384 ] [ 0.815755 0.93306 0.792532 ] [ 0.23391 0.256308 0.486018 ] [ 0.57901 0.703097 0.811616 ] [ 0.184245 0.06694 0.207468 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Si" "Si" "Ni" "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" 6.99877999426 "source-unit" "angstrom" } "b" { "source-value" 7.16153190398 "source-unit" "angstrom" } "c" { "source-value" 8.09770160281 "source-unit" "angstrom" } "alpha" { "source-value" 87.4859360914 "source-unit" "degree" } "beta" { "source-value" 88.5295178999 "source-unit" "degree" } "gamma" { "source-value" 69.3283945981 "source-unit" "degree" } }