{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P6_3/mcm" } "basis-atom-coordinates" { "source-value" [ [ 0.759969 0.759969 0.25 ] [ 0 0.240031 0.25 ] [ 0.759969 0 0.75 ] [ 0.333333 0.666667 0.5 ] [ 0.240031 0 0.25 ] [ 0.666667 0.333333 0.5 ] [ 0 0.759969 0.75 ] [ 0.333333 0.666667 0 ] [ 0.240031 0.240031 0.75 ] [ 0.666667 0.333333 0 ] [ 0.605997 0.605997 0.75 ] [ 0.394003 0 0.75 ] [ 0.605997 0 0.25 ] [ 0 0.394003 0.75 ] [ 0.394003 0.394003 0.25 ] [ 0 0.605997 0.25 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.9835935541 "source-unit" "angstrom" } "c" { "source-value" 6.58342474 "source-unit" "angstrom" } "isothermal-bulk-modulus" { "source-value" 62.46271596996348 "source-unit" "GPa" "source-std-uncert-value" 0.8103811471265061 } }