{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.34761 0.323486 0.106029 ] [ 0.978474 0.012345 0.012095 ] [ 0.984221 0.005528 0.499113 ] [ 0.664362 0.66703 0.601234 ] [ 0.348594 0.331225 0.498679 ] [ 0.699538 0.65561 0.022441 ] [ 0.654823 0.173782 0.782447 ] [ 0.832377 0.342189 0.284351 ] [ 0.832379 0.828297 0.289941 ] [ 0.166766 0.170674 0.787017 ] [ 0.168257 0.662056 0.786502 ] [ 0.344162 0.8296 0.28607 ] [ 0.170943 0.170066 0.406651 ] [ 0.030318 0.486626 0.659258 ] [ 0.340715 0.329069 0.900657 ] [ 0.986871 0.006619 0.685831 ] [ 0.997219 0.007074 0.197631 ] [ 0.184395 0.655673 0.412244 ] [ 0.478671 0.044075 0.65658 ] [ 0.479044 0.477476 0.656034 ] [ 0.316587 0.839162 0.904794 ] [ 0.650363 0.186626 0.409513 ] [ 0.529164 0.514269 0.154564 ] [ 0.51799 0.952383 0.143236 ] [ 0.675884 0.655366 0.396401 ] [ 0.825876 0.335713 0.903124 ] [ 0.965215 0.504157 0.143482 ] [ 0.829182 0.833527 0.906242 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ti" "Ti" "Fe" "Fe" "Fe" "Sn" "Sn" "Sn" "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" 6.13145561 "source-unit" "angstrom" } "b" { "source-value" 6.14044105 "source-unit" "angstrom" } "c" { "source-value" 9.70996446 "source-unit" "angstrom" } "alpha" { "source-value" 89.63674546 "source-unit" "degree" } "beta" { "source-value" 89.74025343 "source-unit" "degree" } "gamma" { "source-value" 60.12206683 "source-unit" "degree" } }