{ "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" [ [ 0.252335 0.752745 0.357322 ] [ 0.747665 0.247255 0.642678 ] [ 0.12128 0.232912 0.384641 ] [ 0.288467 0.173772 0.854196 ] [ 0.711533 0.826228 0.145804 ] [ 0.87872 0.767088 0.615359 ] [ 0.273263 0.450053 0.352728 ] [ 0.326552 0.090531 0.410271 ] [ 0.512792 0.244192 0.77711 ] [ 0.9304 0.700057 0.163314 ] [ 0.60981 0.794652 0.970634 ] [ 0.992523 0.721342 0.474805 ] [ 0.128721 0.903542 0.768031 ] [ 0.871279 0.096458 0.231969 ] [ 0.007477 0.278658 0.525195 ] [ 0.39019 0.205348 0.029366 ] [ 0.0696 0.299943 0.836686 ] [ 0.487208 0.755808 0.22289 ] [ 0.673448 0.909469 0.589729 ] [ 0.726737 0.549947 0.647272 ] ] } "species" { "source-value" [ "Mn" "Mn" "P" "P" "P" "P" "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" 5.20685628 "source-unit" "angstrom" } "b" { "source-value" 6.27307036 "source-unit" "angstrom" } "c" { "source-value" 9.10414778 "source-unit" "angstrom" } "alpha" { "source-value" 102.43173564 "source-unit" "degree" } "beta" { "source-value" 102.61545346 "source-unit" "degree" } "gamma" { "source-value" 103.85475571 "source-unit" "degree" } }