{ "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" [ "Si" "Si" ] } "a" { "source-value" [ 4.70064 4.38568 4.19048 4.048657 3.937201 3.845374 3.767287 3.699357 3.639245 3.585334 3.536464 3.491773 3.450602 3.412437 3.376868 3.343564 3.312255 3.282715 3.254754 3.228212 3.202953 3.178857 3.155823 3.13376 3.11874 3.102933 3.08625 3.06859 3.04983 3.029824 3.008396 2.985326 2.960343 2.933101 2.90315 2.869891 2.832501 2.789807 2.740052 2.680427 2.606022 2.50701 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.70064e-10 4.38568e-10 4.19048e-10 4.0486570000000004e-10 3.937201e-10 3.845374e-10 3.767287e-10 3.699357e-10 3.639245e-10 3.585334e-10 3.536464e-10 3.491773e-10 3.450602e-10 3.4124370000000004e-10 3.376868e-10 3.343564e-10 3.312255e-10 3.282715e-10 3.2547540000000003e-10 3.228212e-10 3.202953e-10 3.178857e-10 3.1558229999999997e-10 3.13376e-10 3.11874e-10 3.1029330000000004e-10 3.08625e-10 3.06859e-10 3.04983e-10 3.029824e-10 3.008396e-10 2.985326e-10 2.960343e-10 2.933101e-10 2.9031500000000005e-10 2.8698910000000003e-10 2.832501e-10 2.789807e-10 2.740052e-10 2.680427e-10 2.606022e-10 2.5070100000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ -0.329701 -0.27942 -0.0981321 0.112346 0.308609 0.478278 0.621482 0.742506 0.846595 0.938601 1.02235 1.10044 1.17509 1.25305 1.33038 1.40177 1.46404 1.51579 1.5569 1.58805 1.61029 1.62481 1.63277 1.63521 1.63412 1.63068 1.62463 1.61568 1.60347 1.58761 1.56764 1.54305 1.51326 1.47761 1.43435 1.37884 1.30123 1.17897 0.95848 0.527882 -0.323269 -1.86957 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ -5.2823923405438087e-20 -4.4768019138393605e-20 -1.572249563700077e-20 1.799981346403968e-20 4.9444612476846724e-20 7.662858298429825e-20 9.957239306480256e-20 1.1896257540037249e-19 1.3563947162861762e-19 1.503804578459501e-19 1.6379852682748802e-19 1.7630992405931523e-19 1.8827017253358721e-19 2.0076074146934402e-19 2.131503732779904e-19 2.2458831217388163e-19 2.3456506599160323e-19 2.4285633000424323e-19 2.49442878092352e-19 2.5443365826614403e-19 2.579968990708032e-19 2.6032325952420485e-19 2.615985921143616e-19 2.619895232098368e-19 2.618148859581696e-19 2.612637372006144e-19 2.602944203450304e-19 2.588604722694144e-19 2.569042146154176e-19 2.543631624948288e-19 2.511636157830912e-19 2.4722386347254403e-19 2.424509793191808e-19 2.3673921966602883e-19 2.29808203604448e-19 2.209145211823872e-19 2.0848002842835842e-19 1.8889181706245763e-19 1.5356542475043842e-19 8.457601989411456e-20 -5.179340340293952e-20 -2.995381344949056e-19 ] } }