{ "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" [ "Si" ] } "a" { "source-value" [ 3.83088 3.574197 3.415115 3.299533 3.2087 3.133864 3.070225 3.014865 2.965875 2.921939 2.882112 2.84569 2.812137 2.781033 2.752045 2.724904 2.699388 2.675314 2.652526 2.630896 2.61031 2.590673 2.5719 2.55392 2.535743 2.517011 2.49769 2.477741 2.457122 2.435787 2.413684 2.390755 2.366937 2.342158 2.316336 2.289381 2.261189 2.231639 2.200596 2.167899 2.133363 2.096768 2.057854 2.016305 1.97174 1.923687 1.871551 1.814575 1.751767 1.681795 1.602812 1.512151 1.405747 1.27696 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.83088e-10 3.574197e-10 3.415115e-10 3.299533e-10 3.2087e-10 3.1338640000000003e-10 3.070225e-10 3.014865e-10 2.9658750000000004e-10 2.921939e-10 2.882112e-10 2.8456899999999997e-10 2.812137e-10 2.781033e-10 2.752045e-10 2.7249040000000003e-10 2.699388e-10 2.6753140000000004e-10 2.652526e-10 2.630896e-10 2.6103100000000004e-10 2.590673e-10 2.5719e-10 2.5539200000000005e-10 2.535743e-10 2.517011e-10 2.49769e-10 2.4777410000000003e-10 2.457122e-10 2.435787e-10 2.413684e-10 2.3907550000000003e-10 2.3669370000000003e-10 2.342158e-10 2.3163360000000002e-10 2.2893810000000003e-10 2.261189e-10 2.231639e-10 2.2005960000000002e-10 2.1678989999999998e-10 2.1333630000000002e-10 2.096768e-10 2.057854e-10 2.016305e-10 1.97174e-10 1.923687e-10 1.871551e-10 1.8145750000000002e-10 1.7517670000000002e-10 1.681795e-10 1.602812e-10 1.512151e-10 1.405747e-10 1.2769600000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0 0 0.163949 0.865907 1.72811 2.48799 3.06217 3.45389 3.69404 3.81514 3.87538 3.92655 3.96946 4.00466 4.03262 4.05376 4.06846 4.07705 4.07985 4.07684 4.06709 4.04939 4.0223 3.98411 3.93274 3.86572 3.78003 3.672 3.53714 3.36989 3.16336 2.9089 2.59559 2.2095 1.73263 0.851465 -1.27862 -4.212 -7.56258 -11.0871 -14.4221 -18.4755 -23.8838 -31.3329 -44.9828 -65.3798 -91.9964 -142.459 -247.902 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.62675256967666e-20 1.3873359626170378e-19 2.76873746298174e-19 3.9861994436256596e-19 4.9061372233357795e-19 5.53374185440626e-19 5.91850457306136e-19 6.112528163438759e-19 6.209043283870919e-19 6.2910266622327e-19 6.35977606159764e-19 6.41617267911444e-19 6.460969537801079e-19 6.494839551843838e-19 6.518391548363639e-19 6.532154245649699e-19 6.5366403402249e-19 6.53181778855656e-19 6.51619656637506e-19 6.487838039953259e-19 6.4444350749382005e-19 6.383247949285739e-19 6.300944135597159e-19 6.193566257586479e-19 6.05627574181902e-19 5.883192600048e-19 5.66712305918676e-19 5.3991590171502595e-19 5.06826147693024e-19 4.6605716106426e-19 4.1585936494440596e-19 3.5400092728229995e-19 2.7759793013674194e-19 1.36419732766881e-19 -2.04857508776508e-19 -6.748367982407999e-19 -1.2116588968755718e-18 -1.77634925588214e-18 -2.31067516332114e-18 -2.9601014401466997e-18 -3.82660662911292e-18 -5.020084025545859e-18 -7.20703910918952e-18 -1.047499878955932e-17 -1.473944824921176e-17 -2.2824448110300598e-17 -3.9718279192186794e-17 ] } }