{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cc" } "basis-atom-coordinates" { "source-value" [ [ 0.037316 0.001413 0.493933 ] [ 0.037316 0.998587 0.993933 ] [ 0.537316 0.501413 0.493933 ] [ 0.537316 0.498587 0.993933 ] [ 0.535052 0.830265 0.308057 ] [ 0.535052 0.169735 0.808057 ] [ 0.035052 0.330265 0.308057 ] [ 0.035052 0.669735 0.808057 ] [ 0.534324 0.165238 0.197812 ] [ 0.534324 0.834762 0.697812 ] [ 0.034324 0.665238 0.197812 ] [ 0.034324 0.334762 0.697812 ] [ 0.811148 0.166782 0.243598 ] [ 0.811148 0.833218 0.743598 ] [ 0.410386 0.026267 0.250815 ] [ 0.410386 0.973733 0.750815 ] [ 0.515065 0.827355 0.528926 ] [ 0.515065 0.172645 0.028926 ] [ 0.89971 0.204764 0.763859 ] [ 0.89971 0.795236 0.263859 ] [ 0.311148 0.666782 0.243598 ] [ 0.311148 0.333218 0.743598 ] [ 0.910386 0.526267 0.250815 ] [ 0.910386 0.473733 0.750815 ] [ 0.015065 0.327355 0.528926 ] [ 0.015065 0.672645 0.028926 ] [ 0.39971 0.704764 0.763859 ] [ 0.39971 0.295236 0.263859 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Li" "Li" "Li" "Li" "S" "S" "S" "S" "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" 5.1984615406 "source-unit" "angstrom" } "b" { "source-value" 9.07048256 "source-unit" "angstrom" } "c" { "source-value" 8.80271443044 "source-unit" "angstrom" } "beta" { "source-value" 90.3288509072 "source-unit" "degree" } }