{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "diamond" ] } "species" { "source-value" [ "W" "W" "W" "W" "W" "W" "W" "W" ] } "a" { "source-value" [ 9.36941 8.741624 8.352548 8.069863 7.847707 7.664675 7.50903 7.373631 7.253813 7.146357 7.048949 6.95987 6.877807 6.801735 6.730838 6.664457 6.60205 6.54317 6.487438 6.434534 6.384186 6.336158 6.290246 6.24627 6.216333 6.184825 6.151572 6.116371 6.078978 6.039103 5.996391 5.950409 5.900613 5.846314 5.786614 5.720321 5.645795 5.560697 5.461523 5.342677 5.194373 4.99702 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 9.36941e-10 8.741624e-10 8.352548000000001e-10 8.069863e-10 7.847707e-10 7.664675e-10 7.50903e-10 7.373631e-10 7.253813e-10 7.146357e-10 7.048949e-10 6.95987e-10 6.877807e-10 6.801735e-10 6.730838000000001e-10 6.664457e-10 6.60205e-10 6.54317e-10 6.487438e-10 6.434534e-10 6.384186e-10 6.336158e-10 6.290246e-10 6.24627e-10 6.216333e-10 6.184825e-10 6.151572e-10 6.116371e-10 6.078978000000001e-10 6.039103e-10 5.996391e-10 5.950409e-10 5.900613e-10 5.846314e-10 5.786614000000001e-10 5.720321000000001e-10 5.645795e-10 5.560697e-10 5.461523e-10 5.342677e-10 5.194373e-10 4.997020000000001e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] ] } "cohesive-potential-energy" { "source-value" [ 0.897247 2.3732 3.2214 3.68927 3.9637 4.15098 4.29643 4.40794 4.48891 4.55069 4.60162 4.64598 4.68587 4.7223 4.75566 4.78603 4.81334 4.83745 4.85819 4.87542 4.889 4.89882 4.90478 4.90678 4.90582 4.90426 4.90227 4.89903 4.89346 4.88417 4.86931 4.84637 4.812 4.76149 4.68821 4.5824 4.4293 4.20534 3.87052 3.35077 2.54655 1.0743 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.437548178326598e-19 3.8022855878088e-19 5.1612518087676e-19 5.910862190517179e-19 6.3505475241858e-19 6.650603164201319e-19 6.883639755616619e-19 7.06229847207396e-19 7.192026714128939e-19 7.29100918657746e-19 7.372608042547078e-19 7.443680598031319e-19 7.50759142396158e-19 7.565958718738199e-19 7.619407331248439e-19 7.66806543562302e-19 7.71182087949756e-19 7.7504493581432985e-19 7.783678501532459e-19 7.811284004936279e-19 7.833041563626e-19 7.848774938171879e-19 7.858323910910519e-19 7.86152826417852e-19 7.85999017460988e-19 7.857490779060839e-19 7.854302447559179e-19 7.849111395265019e-19 7.84018727141364e-19 7.82530305048378e-19 7.801494705702538e-19 7.76474077371858e-19 7.709673962808e-19 7.62874802102466e-19 7.511340517285139e-19 7.341814207641599e-19 7.096520964976199e-19 6.737697486025559e-19 6.20125670542968e-19 5.36852539990818e-19 4.0800229073126997e-19 1.7212183579062e-19 ] } }