{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P6_3mc" } "basis-atom-coordinates" { "source-value" [ [ 0.150149 0.849851 0.54228 ] [ 0.300297 0.150149 0.04228 ] [ 0.849851 0.699703 0.04228 ] [ 0.150149 0.300297 0.54228 ] [ 0.699703 0.849851 0.54228 ] [ 0.849851 0.150149 0.04228 ] [ 0.527713 0.472287 0.371859 ] [ 0.055426 0.527713 0.871859 ] [ 0.472287 0.944574 0.871859 ] [ 0.527713 0.055426 0.371859 ] [ 0.944574 0.472287 0.371859 ] [ 0.472287 0.527713 0.871859 ] [ 0.333333 0.666667 0.251909 ] [ 0.666667 0.333333 0.751909 ] [ 0.333333 0.666667 0.60512 ] [ 0.666667 0.333333 0.10512 ] [ 0.18521 0.81479 0.142418 ] [ 0.370421 0.18521 0.642418 ] [ 0.81479 0.629579 0.642418 ] [ 0.18521 0.370421 0.142418 ] [ 0.629579 0.81479 0.142418 ] [ 0.81479 0.18521 0.642418 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Mn" "Mn" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" ] } "a" { "source-value" 10.0927099514 "source-unit" "angstrom" } "c" { "source-value" 7.76062934 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.496306912727273 "source-unit" "eV" } }