{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Si" "Si" ] } "a" { "source-value" [ 4.7856 4.464947 4.266219 4.121833 4.008363 3.914876 3.835377 3.76622 3.705021 3.650136 3.600383 3.554884 3.512969 3.474114 3.437902 3.403996 3.372121 3.342047 3.313581 3.286559 3.260843 3.236312 3.212861 3.1904 3.175109 3.159016 3.142031 3.124052 3.104952 3.084585 3.062769 3.039283 3.013849 2.986114 2.955621 2.921761 2.883695 2.84023 2.789575 2.728871 2.653122 2.55232 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.785599999999999e-10 4.464947000000001e-10 4.2662190000000006e-10 4.121833e-10 4.0083630000000004e-10 3.914876e-10 3.835377e-10 3.76622e-10 3.705021e-10 3.6501359999999997e-10 3.600383e-10 3.554884e-10 3.512969e-10 3.474114e-10 3.4379019999999997e-10 3.403996e-10 3.372121e-10 3.342047e-10 3.3135810000000005e-10 3.286559e-10 3.260843e-10 3.236312e-10 3.2128610000000003e-10 3.1904e-10 3.175109e-10 3.159016e-10 3.142031e-10 3.124052e-10 3.104952e-10 3.0845850000000003e-10 3.062769e-10 3.0392830000000003e-10 3.013849e-10 2.9861140000000005e-10 2.955621e-10 2.921761e-10 2.883695e-10 2.84023e-10 2.789575e-10 2.728871e-10 2.653122e-10 2.55232e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.870472 1.33577 1.71749 2.04365 2.32806 2.57903 2.80205 3.00107 3.17903 3.33823 3.4805 3.60735 3.72001 3.81955 3.90688 3.98277 4.04791 4.10291 4.1483 4.18457 4.21215 4.23142 4.24275 4.24646 4.24466 4.2387 4.22761 4.21016 4.18473 4.14923 4.10088 4.03593 3.94921 3.83347 3.67816 3.46759 3.17725 2.76715 2.16754 1.24614 -0.279676 -3.13371 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.3946498874610178e-19 2.140139464766016e-19 2.751722324457792e-19 3.27428825109792e-19 3.729963303819648e-19 4.132061570341824e-19 4.48937900031264e-19 4.808244191384256e-19 5.093367542821825e-19 5.348434060853184e-19 5.5763757286944e-19 5.7796118330428805e-19 5.960113051142208e-19 6.11959371197664e-19 6.259511796271104e-19 6.381100980023616e-19 6.485466765102529e-19 6.573586479246528e-19 6.64630927606464e-19 6.704420222101056e-19 6.748608253302721e-19 6.779482196785536e-19 6.797634857899201e-19 6.8035789331623685e-19 6.800695015244928e-19 6.79114604258496e-19 6.773377903860289e-19 6.745419921827328e-19 6.704676570360384e-19 6.647799300321984e-19 6.570334060706304e-19 6.466272689185343e-19 6.327331932629568e-19 6.141896010538177e-19 5.893061959561729e-19 5.555691628519873e-19 5.0905156684368e-19 4.43346303624672e-19 3.472781912648832e-19 1.996536374243712e-19 -4.480903485988608e-20 -5.020756898367169e-19 ] } }