{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Cu" ] } "a" { "source-value" [ 3.57573 3.336143 3.187656 3.079773 2.99499 2.925138 2.865737 2.814064 2.768337 2.727328 2.690153 2.656157 2.624839 2.595807 2.56875 2.543416 2.519599 2.497128 2.475859 2.455669 2.436454 2.418125 2.400603 2.38382 2.366853 2.349369 2.331335 2.312715 2.293469 2.273555 2.252924 2.231522 2.209291 2.186162 2.16206 2.136901 2.110586 2.083004 2.054028 2.023509 1.991273 1.957116 1.920793 1.882012 1.840416 1.795562 1.746899 1.693718 1.635093 1.569781 1.49606 1.411436 1.312119 1.19191 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.57573e-10 3.3361429999999997e-10 3.187656e-10 3.079773e-10 2.99499e-10 2.9251380000000003e-10 2.865737e-10 2.814064e-10 2.768337e-10 2.727328e-10 2.690153e-10 2.656157e-10 2.624839e-10 2.595807e-10 2.56875e-10 2.543416e-10 2.519599e-10 2.497128e-10 2.475859e-10 2.455669e-10 2.436454e-10 2.418125e-10 2.400603e-10 2.38382e-10 2.366853e-10 2.349369e-10 2.3313350000000003e-10 2.312715e-10 2.293469e-10 2.2735550000000002e-10 2.2529240000000002e-10 2.231522e-10 2.209291e-10 2.186162e-10 2.16206e-10 2.136901e-10 2.110586e-10 2.083004e-10 2.0540280000000002e-10 2.0235089999999998e-10 1.991273e-10 1.957116e-10 1.920793e-10 1.882012e-10 1.840416e-10 1.7955620000000003e-10 1.7468990000000001e-10 1.693718e-10 1.635093e-10 1.5697810000000002e-10 1.49606e-10 1.411436e-10 1.3121190000000002e-10 1.19191e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.06238 1.39845 1.65258 1.8444 1.99378 2.11747 2.22258 2.31169 2.38771 2.45414 2.51277 2.56458 2.61068 2.65195 2.68878 2.72128 2.74952 2.77367 2.79392 2.8104 2.82314 2.83213 2.83737 2.83903 2.83733 2.83211 2.82343 2.81154 2.79641 2.77769 2.75465 2.72631 2.69145 2.64859 2.59597 2.53171 2.45281 2.3485 2.1919 1.92841 1.46208 0.760186 -0.239795 -1.68463 -3.8139 -7.02355 -12.0202 -20.1831 -34.434 -61.6284 -120.12 -268.636 -736.088 -2738.2 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.70212041242892e-19 2.2405639138173e-19 2.64772506181572e-19 2.9550545837496e-19 3.19438772933652e-19 3.3925609571959796e-19 3.5609657431957196e-19 3.7037357030514596e-19 3.82553317076814e-19 3.93196576456476e-19 4.02590138061618e-19 4.1089101520237195e-19 4.1827704948511197e-19 4.248892324536299e-19 4.3079004899665197e-19 4.35997123057152e-19 4.40521669871568e-19 4.44390926442678e-19 4.4763533412652795e-19 4.5027572121935995e-19 4.52316894251076e-19 4.53757251045042e-19 4.54596791601258e-19 4.54862752922502e-19 4.54590382894722e-19 4.53754046691774e-19 4.523633573734619e-19 4.504583693556359e-19 4.48034276108394e-19 4.45035001449546e-19 4.413435864848099e-19 4.36803017904054e-19 4.3121783015793e-19 4.24350901104606e-19 4.1592024765649794e-19 4.0562466060641394e-19 3.9298348696415396e-19 3.762711824949e-19 3.5118109640645996e-19 3.0896534427719397e-19 2.34251041303872e-19 1.2179522466939239e-19 -3.8419394595003e-20 -2.69907482293542e-19 -6.110541464412599e-19 -1.1252967697730699e-18 -1.92584835760068e-18 -3.23368912216854e-18 -5.516935021515599e-18 -9.873958247080559e-18 -1.9245345727608e-17 -4.3040232225122404e-17 -1.179342994167792e-16 -4.3870800592187996e-16 ] } }