{ "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" [ "Fe" ] } "a" { "source-value" [ 3.42521 3.195708 3.053471 2.950129 2.868914 2.802003 2.745103 2.695604 2.651802 2.612519 2.576909 2.544344 2.514344 2.486534 2.460616 2.436348 2.413534 2.392009 2.371635 2.352295 2.333889 2.316331 2.299546 2.28347 2.272526 2.261007 2.248851 2.235983 2.222313 2.207736 2.192121 2.175312 2.157108 2.137257 2.115433 2.091198 2.063954 2.032844 1.996589 1.953142 1.898927 1.82678 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.42521e-10 3.195708e-10 3.053471e-10 2.950129e-10 2.868914e-10 2.802003e-10 2.745103e-10 2.695604e-10 2.651802e-10 2.612519e-10 2.5769090000000005e-10 2.5443440000000003e-10 2.514344e-10 2.486534e-10 2.460616e-10 2.4363480000000005e-10 2.413534e-10 2.392009e-10 2.371635e-10 2.3522949999999997e-10 2.333889e-10 2.316331e-10 2.2995459999999998e-10 2.28347e-10 2.2725260000000002e-10 2.2610070000000004e-10 2.2488510000000003e-10 2.235983e-10 2.2223130000000002e-10 2.2077360000000001e-10 2.1921210000000003e-10 2.175312e-10 2.1571080000000002e-10 2.137257e-10 2.115433e-10 2.0911979999999999e-10 2.063954e-10 2.032844e-10 1.996589e-10 1.953142e-10 1.898927e-10 1.8267800000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.60473 1.763 2.17585 2.47208 2.56433 2.54097 2.56925 2.82413 3.07349 3.22959 3.32293 3.3881 3.44121 3.49535 3.53856 3.57174 3.60463 3.64124 3.67825 3.71241 3.74098 3.76169 3.77367 3.7773 3.77577 3.77131 3.76441 3.75584 3.74511 3.73022 3.70822 3.6744 3.62038 3.54061 3.43473 3.30354 3.11517 2.7912 2.40317 2.15297 1.7438 -0.375709 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.57106090987882e-19 2.8246374057419996e-19 3.4860960290889e-19 3.96070881337872e-19 4.10850960786522e-19 4.07108276169498e-19 4.1163923169044993e-19 4.524755097378419e-19 4.92427386283266e-19 5.17437363540006e-19 5.32392080241762e-19 5.4283346536554e-19 5.51342625468714e-19 5.6001680976519e-19 5.66939815000704e-19 5.72255837072316e-19 5.7752539602154195e-19 5.833909646786159e-19 5.893206204010499e-19 5.94793655782794e-19 5.99371074426132e-19 6.02689182235146e-19 6.04608589842678e-19 6.0519017996082e-19 6.04945046935818e-19 6.04230476157054e-19 6.03124974279594e-19 6.01751908904256e-19 6.000327733759739e-19 5.97647132367948e-19 5.941223437731479e-19 5.8870378239696e-19 5.80048824220092e-19 5.67268261210674e-19 5.503044150098819e-19 5.29285459748436e-19 4.99105258493778e-19 4.471995420820799e-19 3.8503028215297796e-19 3.4494382277029797e-19 2.7938756143692e-19 -6.01952180983506e-20 ] } }