{ "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" [ [ 0.653628 0.827553 0.167295 ] [ 0.799733 0.304167 0.975492 ] [ 0.274931 0.813968 0.558986 ] [ 0.725069 0.186032 0.441014 ] [ 0.200267 0.695833 0.024508 ] [ 0.346372 0.172447 0.832705 ] [ 1 0.5 0.5 ] [ 0.780589 0.759604 0.7319 ] [ 0.219411 0.240396 0.2681 ] [ 0.564208 0.725228 0.842042 ] [ 0.832614 0.967447 0.784951 ] [ 0.167386 0.032553 0.215049 ] [ 0.016356 0.541604 0.753327 ] [ 0.435792 0.274772 0.157958 ] [ 0.983644 0.458396 0.246673 ] [ 0.743955 0.769524 0.512096 ] [ 0.256045 0.230476 0.487904 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "Cu" "Si" "Si" "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" 6.27948194587 "source-unit" "angstrom" } "b" { "source-value" 6.74770634485 "source-unit" "angstrom" } "c" { "source-value" 7.61876089569 "source-unit" "angstrom" } "alpha" { "source-value" 83.4789905145 "source-unit" "degree" } "beta" { "source-value" 87.683445827 "source-unit" "degree" } "gamma" { "source-value" 69.9272346318 "source-unit" "degree" } }