{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "diamond" ] } "species" { "source-value" [ "Ar" "Ar" "Ar" "Ar" "Ar" "Ar" "Ar" "Ar" ] } "a" { "source-value" [ 7.07152 6.597703 6.30405 6.090695 5.923024 5.784882 5.66741 5.565218 5.474787 5.393685 5.320167 5.252935 5.190998 5.133583 5.080074 5.029974 4.982873 4.938433 4.89637 4.856441 4.818441 4.782193 4.74754 4.71435 4.680796 4.646218 4.610553 4.573728 4.535668 4.496284 4.455483 4.413158 4.369192 4.323451 4.275787 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.07152e-10 6.597703000000001e-10 6.304050000000001e-10 6.090695e-10 5.923024000000001e-10 5.784882e-10 5.667410000000001e-10 5.565218e-10 5.474787000000001e-10 5.393685e-10 5.320167e-10 5.252935e-10 5.190997999999999e-10 5.133582999999999e-10 5.080074e-10 5.029974e-10 4.982873e-10 4.938433e-10 4.896370000000001e-10 4.856441000000001e-10 4.818441e-10 4.782193e-10 4.74754e-10 4.714349999999999e-10 4.680796e-10 4.6462180000000005e-10 4.6105530000000006e-10 4.573728e-10 4.5356680000000003e-10 4.4962840000000004e-10 4.455483e-10 4.4131580000000004e-10 4.3691920000000003e-10 4.3234510000000005e-10 4.2757870000000004e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] ] } "cohesive-potential-energy" { "source-value" [ 0.00618049 0.00926418 0.0119744 0.0144583 0.0167801 0.0189551 0.0210069 0.0229355 0.0247472 0.0264455 0.0280341 0.0295163 0.0308879 0.0321484 0.0333016 0.0343456 0.0352743 0.036086 0.0367784 0.0373495 0.0377966 0.0381174 0.038315 0.0383817 0.0383064 0.0380546 0.0375798 0.0368263 0.0357162 0.0341525 0.0320106 0.0291274 0.0252891 0.0202137 0.0135183 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 9.902236664670659e-22 1.484285272917012e-21 1.9185103886169598e-21 2.31647504273622e-21 2.6884684136183398e-21 3.0369418315133396e-21 3.3656764332774594e-21 3.6746722189107e-21 3.96493855969248e-21 4.2370362174446996e-21 4.49155799752194e-21 4.7290326182134196e-21 4.9487871653328595e-21 5.15074153004856e-21 5.33550453948144e-21 5.502771780071039e-21 5.65156592407062e-21 5.7816146014523994e-21 5.89254931159056e-21 5.9840496191583e-21 6.0556829364644395e-21 6.10708076288316e-21 6.138739773171e-21 6.149426291319779e-21 6.137361901265759e-21 6.09701909362164e-21 6.020947747039319e-21 5.900223737667419e-21 5.722366109527079e-21 5.4718337492685e-21 5.12866353603204e-21 4.6667239689171595e-21 4.05176051148894e-21 3.23859178266858e-21 2.16587043914022e-21 ] } }