{ "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" [ "Zn" "Zn" ] } "a" { "source-value" [ 4.65397 4.342137 4.148876 4.008461 3.898113 3.807198 3.729885 3.662631 3.603115 3.54974 3.501355 3.457108 3.416346 3.378559 3.343343 3.310371 3.279372 3.250125 3.222442 3.196164 3.171155 3.147299 3.124493 3.10265 3.087779 3.072129 3.055612 3.038126 3.019553 2.999746 2.97853 2.955689 2.930955 2.903983 2.874329 2.8414 2.804381 2.762111 2.712849 2.653815 2.58015 2.48212 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.6539700000000004e-10 4.3421370000000003e-10 4.1488759999999996e-10 4.0084609999999996e-10 3.898113e-10 3.8071980000000004e-10 3.729885e-10 3.6626310000000004e-10 3.603115e-10 3.54974e-10 3.5013550000000006e-10 3.457108e-10 3.416346e-10 3.378559e-10 3.343343e-10 3.310371e-10 3.279372e-10 3.250125e-10 3.222442e-10 3.196164e-10 3.1711550000000005e-10 3.147299e-10 3.1244930000000003e-10 3.10265e-10 3.087779e-10 3.072129e-10 3.055612e-10 3.038126e-10 3.019553e-10 2.999746e-10 2.9785300000000004e-10 2.955689e-10 2.930955e-10 2.9039830000000003e-10 2.874329e-10 2.8414e-10 2.804381e-10 2.762111e-10 2.712849e-10 2.653815e-10 2.58015e-10 2.4821200000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.280265 0.416163 0.52449 0.616353 0.696763 0.768469 0.833145 0.891885 0.945446 0.99436 1.03902 1.07972 1.11667 1.15005 1.17999 1.20658 1.22991 1.25003 1.26699 1.28082 1.29155 1.29921 1.3038 1.30532 1.30456 1.30202 1.29723 1.28956 1.27819 1.26202 1.23955 1.20869 1.16646 1.10855 1.02846 0.916066 0.754895 0.516599 0.148704 -0.457556 -1.5667 -3.97654 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 4.4903403432800994e-20 6.66766634535342e-20 8.4032562276666e-20 9.87506374895802e-20 1.116337398035742e-19 1.231223075753346e-19 1.33484545173393e-19 1.42895730721509e-19 1.5147714899087639e-19 1.5931403577842399e-19 1.66469356625868e-19 1.72990215526248e-19 1.78910258188878e-19 1.8425832379317e-19 1.89055240635366e-19 1.93315428305172e-19 1.97053306392294e-19 2.0027688577990197e-19 2.02994177351166e-19 2.05209987635988e-19 2.0692912316427e-19 2.0815639046591398e-19 2.0889178954092e-19 2.09135320389288e-19 2.0901355496510397e-19 2.0860660210006798e-19 2.0783915949238201e-19 2.06610290014104e-19 2.0478861518124599e-19 2.0219789556406796e-19 1.9859780466746996e-19 1.93653487574946e-19 1.86887495649564e-19 1.7760929076206998e-19 1.64777458100364e-19 1.467699540401844e-19 1.20947513012343e-19 8.27682846947766e-20 2.38250074182336e-20 -7.33085531946504e-20 -2.5101301324877996e-19 -6.37111947216636e-19 ] } }