{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "C" "C" "C" "C" ] } "a" { "source-value" [ 4.39926 4.104493 3.921809 3.789079 3.684769 3.598829 3.525748 3.462174 3.405916 3.355461 3.309725 3.267899 3.229368 3.193649 3.160361 3.129193 3.099891 3.072244 3.046076 3.021236 2.997596 2.975046 2.953488 2.93284 2.911966 2.890455 2.868267 2.845358 2.82168 2.79718 2.771797 2.745466 2.718115 2.689659 2.660006 2.629052 2.596677 2.562743 2.527094 2.489546 2.449886 2.407861 2.363173 2.31546 2.264284 2.2091 2.149229 2.0838 2.011673 1.931319 1.840618 1.736506 1.614315 1.46642 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.39926e-10 4.104493e-10 3.921809e-10 3.7890790000000004e-10 3.6847690000000005e-10 3.598829e-10 3.5257480000000003e-10 3.462174e-10 3.405916e-10 3.355461e-10 3.309725e-10 3.267899e-10 3.2293680000000004e-10 3.1936490000000003e-10 3.160361e-10 3.1291930000000003e-10 3.099891e-10 3.072244e-10 3.046076e-10 3.021236e-10 2.9975960000000003e-10 2.9750459999999997e-10 2.953488e-10 2.9328400000000003e-10 2.9119660000000004e-10 2.890455e-10 2.868267e-10 2.8453580000000004e-10 2.8216800000000005e-10 2.7971800000000003e-10 2.771797e-10 2.745466e-10 2.7181150000000003e-10 2.689659e-10 2.660006e-10 2.6290520000000005e-10 2.5966770000000004e-10 2.562743e-10 2.527094e-10 2.4895459999999997e-10 2.4498859999999997e-10 2.407861e-10 2.3631730000000004e-10 2.3154599999999998e-10 2.264284e-10 2.2091e-10 2.149229e-10 2.0838e-10 2.011673e-10 1.9313190000000002e-10 1.8406180000000001e-10 1.7365060000000003e-10 1.614315e-10 1.4664200000000001e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.0125 1.5646 2.01921 2.40834 2.74801 3.04786 3.31439 3.55222 3.76487 3.95506 4.12497 4.2764 4.41085 4.52959 4.63371 4.72415 4.80174 4.86722 4.92124 4.96437 4.99715 5.02004 5.0335 5.0379 5.03314 5.01767 4.98945 4.94608 4.88461 4.80154 4.69259 4.55254 4.37502 4.15211 3.87401 3.52846 3.09997 2.56879 1.90955 1.08926 0.0644997 -1.22269 -2.85068 -4.92759 -7.6051 -11.1013 -15.7373 -22.0009 -30.6598 -42.975 -61.1301 -89.1657 -135.23 -217.786 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.622203841925e-19 2.5067655615563998e-19 3.23513108113914e-19 3.8585860747275597e-19 4.402797411998339e-19 4.88321007570324e-19 5.310238213963259e-19 5.69128388282748e-19 6.031986744047579e-19 6.33670471806804e-19 6.60893054995098e-19 6.851548157637599e-19 7.0669608060789e-19 7.2572032596000595e-19 7.424021890732139e-19 7.5689227455111e-19 7.693235630543159e-19 7.798146156537479e-19 7.884695738306159e-19 7.953797616530579e-19 8.0063169665931e-19 8.042990789745359e-19 8.064556087239e-19 8.071605664428599e-19 8.06397930365076e-19 8.039193631122779e-19 7.993980206511299e-19 7.92449380589472e-19 7.82600800820274e-19 7.69291519521636e-19 7.5183580509420595e-19 7.293973213350359e-19 7.00955481728268e-19 6.65241362379774e-19 6.20684830188234e-19 5.6532161660036395e-19 4.96669950010098e-19 4.1156553156528596e-19 3.0594363914547e-19 1.7451869203508396e-19 1.0333991224000978e-20 -1.95896534862546e-19 -4.56729288701112e-19 -7.89486955993206e-19 -1.2184713519233399e-18 -1.7786243467024197e-18 -2.5213934342248197e-18 -3.52493279069706e-18 -4.91224151631132e-18 -6.885354084615e-18 -9.79412178540834e-18 -1.4285920109425378e-17 -2.1666234621581996e-17 -3.48931640412324e-17 ] } }