{ "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" [ 4.85954 4.533932 4.332133 4.185516 4.070292 3.975361 3.894634 3.824408 3.762263 3.70653 3.656008 3.609806 3.567243 3.527788 3.491016 3.456587 3.424219 3.39368 3.364774 3.337335 3.311222 3.286311 3.262498 3.23969 3.216632 3.19287 3.168361 3.143055 3.1169 3.089836 3.061797 3.032712 3.002498 2.971065 2.93831 2.904117 2.868354 2.83087 2.791491 2.750014 2.706205 2.659783 2.61042 2.557715 2.501183 2.440226 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.85954e-10 4.533932e-10 4.332133e-10 4.185516e-10 4.0702920000000004e-10 3.975361e-10 3.894634e-10 3.824408e-10 3.762263e-10 3.70653e-10 3.656008e-10 3.609806e-10 3.567243e-10 3.5277880000000003e-10 3.491016e-10 3.456587e-10 3.424219e-10 3.3936799999999997e-10 3.364774e-10 3.337335e-10 3.311222e-10 3.286311e-10 3.262498e-10 3.23969e-10 3.2166320000000004e-10 3.19287e-10 3.168361e-10 3.143055e-10 3.1169e-10 3.089836e-10 3.061797e-10 3.032712e-10 3.002498e-10 2.971065e-10 2.93831e-10 2.904117e-10 2.868354e-10 2.8308700000000003e-10 2.7914910000000004e-10 2.750014e-10 2.7062050000000005e-10 2.659783e-10 2.6104200000000003e-10 2.557715e-10 2.5011830000000004e-10 2.440226e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0 0 0 0 0 0 0 5.5808e-07 0.00599545 0.100598 0.387953 0.857008 1.41318 1.94351 2.38647 2.71198 2.91836 3.02475 3.05506 3.02955 2.96153 2.86503 2.75421 2.64197 2.53857 2.44783 2.31096 1.94457 1.1686 -0.103518 -1.84076 -3.91186 -6.1474 -8.39351 -10.5404 -12.5272 -14.3393 -16.0132 -17.6575 -19.4358 -21.4146 ] "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 0.0 0.0 0.0 0.0 0.0 8.941427359027199e-26 9.6057699003153e-22 1.61175765027132e-20 6.215692316902019e-20 1.3730781927510718e-19 2.26416397563612e-19 3.1138463099453397e-19 3.82354647174198e-19 4.34507098787532e-19 4.675728201600239e-19 4.8461837736915e-19 4.89474574746804e-19 4.8538742215347e-19 4.74489416689002e-19 4.59028412170902e-19 4.41273090712914e-19 4.23290260172898e-19 4.06723753777338e-19 3.92185603000422e-19 3.70256611410864e-19 3.1155446171773795e-19 1.8723036144924e-19 -1.6585412079841197e-20 -2.9492226608018396e-19 -6.267490687479239e-19 -9.8492206398516e-19 -1.3447885599245339e-18 -1.68875825930136e-18 -2.00707871294448e-18 -2.29740914079162e-18 -2.56559748755688e-18 -2.8290433914854996e-18 -3.1139584623097197e-18 -3.4309971746456396e-18 ] } }