{ "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" [ "Rh" "Rh" "Rh" "Rh" ] } "a" { "source-value" [ 5.85861 5.466061 5.222776 5.046015 4.907103 4.792656 4.695332 4.610668 4.535747 4.468556 4.407648 4.351948 4.300634 4.253067 4.208736 4.167228 4.128206 4.091389 4.05654 4.02346 3.991978 3.961946 3.933238 3.90574 3.88702 3.867319 3.846526 3.824515 3.801133 3.776199 3.749492 3.720739 3.689602 3.655649 3.61832 3.576867 3.530266 3.477055 3.415042 3.340728 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.85861e-10 5.466061e-10 5.222775999999999e-10 5.046015e-10 4.907103e-10 4.792656e-10 4.695332e-10 4.6106680000000006e-10 4.535747e-10 4.4685560000000004e-10 4.407648e-10 4.3519480000000006e-10 4.3006339999999996e-10 4.253067e-10 4.2087360000000003e-10 4.167228e-10 4.1282059999999996e-10 4.0913890000000006e-10 4.05654e-10 4.0234600000000003e-10 3.991978e-10 3.961946e-10 3.933238e-10 3.90574e-10 3.8870200000000003e-10 3.8673190000000005e-10 3.846526e-10 3.824515e-10 3.801133e-10 3.776199e-10 3.7494920000000004e-10 3.720739e-10 3.689602e-10 3.655649e-10 3.6183200000000005e-10 3.576867e-10 3.530266e-10 3.477055e-10 3.415042e-10 3.3407280000000003e-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" [ 3.25214 4.85935 6.28157 7.58312 8.79234 9.92359 10.9899 11.9934 12.9361 13.822 14.6505 15.4215 16.1357 16.7935 17.393 17.9335 18.4143 18.8357 19.1951 19.4913 19.7233 19.8905 19.9936 20.0282 20.0108 19.952 19.8402 19.6597 19.3897 19.0016 18.4562 17.6977 16.6462 15.1845 13.127 10.1811 5.85852 -0.711613 -11.1951 -29.1572 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.210502675568512e-19 7.785536962284481e-19 1.0064184595918658e-18 1.2149497576720896e-18 1.4086881590124672e-18 1.5899343892404675e-18 1.7607760844929923e-18 1.921554508390272e-18 2.072591698433088e-18 2.21452852526976e-18 2.34726885830304e-18 2.47079667576672e-18 2.585224130024256e-18 2.6906153081404805e-18 2.7866657965574402e-18 2.8732634429116798e-18 2.9502960948397443e-18 3.017811817640256e-18 3.075394045391808e-18 3.122850516899904e-18 3.160021014502464e-18 3.18680940760224e-18 3.2033278485626882e-18 3.2088713796706558e-18 3.206083592350464e-18 3.1966627938201604e-18 3.1787504591996162e-18 3.1498311711941762e-18 3.1065724024325763e-18 3.0443919277793283e-18 2.957009214880896e-18 2.8354841181932165e-18 2.6670152465160964e-18 2.43282508985376e-18 2.10317725012416e-18 1.6311920394026883e-18 9.386383776489216e-19 -1.1401297116573505e-19 -1.793652748751808e-18 -4.671498416798976e-18 ] } }