{ "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" [ "Cu" "Cu" ] } "a" { "source-value" [ 4.30521 4.016745 3.837966 3.708073 3.605994 3.521891 3.450373 3.388158 3.333102 3.283726 3.238968 3.198036 3.160329 3.125374 3.092797 3.062295 3.03362 3.006564 2.980955 2.956647 2.933512 2.911443 2.890347 2.87014 2.856384 2.841906 2.826627 2.810452 2.79327 2.774947 2.755321 2.734192 2.711311 2.68636 2.658928 2.628467 2.594222 2.555119 2.509549 2.454939 2.386794 2.29611 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.30521e-10 4.0167450000000006e-10 3.837966e-10 3.7080730000000005e-10 3.605994e-10 3.521891e-10 3.450373e-10 3.388158e-10 3.3331019999999997e-10 3.2837260000000003e-10 3.238968e-10 3.1980360000000003e-10 3.160329e-10 3.125374e-10 3.092797e-10 3.0622950000000003e-10 3.03362e-10 3.006564e-10 2.980955e-10 2.956647e-10 2.933512e-10 2.9114429999999996e-10 2.8903470000000003e-10 2.87014e-10 2.856384e-10 2.841906e-10 2.8266269999999997e-10 2.8104520000000005e-10 2.7932700000000003e-10 2.7749470000000004e-10 2.755321e-10 2.7341920000000003e-10 2.711311e-10 2.6863600000000003e-10 2.658928e-10 2.628467e-10 2.594222e-10 2.555119e-10 2.509549e-10 2.454939e-10 2.386794e-10 2.2961100000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.900151 1.34722 1.68267 1.95113 2.17554 2.36673 2.53562 2.68446 2.81505 2.92996 3.0312 3.11877 3.19169 3.25485 3.30913 3.35527 3.39395 3.42571 3.45151 3.474 3.4909 3.50261 3.50943 3.51164 3.51062 3.50771 3.50187 3.49244 3.47857 3.459 3.43136 3.39463 3.34608 3.28199 3.19704 3.08337 2.92897 2.7146 2.40741 1.9433 1.1944 -0.152508 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.442200887389741e-19 2.1584843870741763e-19 2.695934534521536e-19 3.126054870141504e-19 3.485599325615232e-19 3.791919473745984e-19 4.0625110832328964e-19 4.3009790514727683e-19 4.51020729638304e-19 4.6943134118791685e-19 4.85651777296896e-19 4.996820379652416e-19 5.113651098841152e-19 5.21484457421088e-19 5.301810721187904e-19 5.375735150471616e-19 5.43770734216416e-19 5.488592471640768e-19 5.529928628457408e-19 5.5659615806592e-19 5.59303836555072e-19 5.611799853780288e-19 5.622726698334144e-19 5.626267508666112e-19 5.624633288512896e-19 5.619970954546368e-19 5.610614243080896e-19 5.595505717546753e-19 5.573283527816256e-19 5.541928931347201e-19 5.497644769548289e-19 5.438796822266304e-19 5.361011147326465e-19 5.258327647699392e-19 5.122222743762432e-19 4.940103327276096e-19 4.692727257024576e-19 4.34926865482368e-19 3.857096018680128e-19 3.11350982720064e-19 1.91363975588352e-19 -2.4434475208496644e-20 ] } }