{ "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" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "a" { "source-value" [ 8.14063 7.595178 7.257129 7.011519 6.818498 6.659471 6.524239 6.406597 6.302494 6.209131 6.124498 6.047102 5.975801 5.909705 5.848107 5.790431 5.73621 5.685051 5.636628 5.590663 5.546918 5.505189 5.465298 5.42709 5.401079 5.373703 5.344811 5.314227 5.281738 5.247091 5.209981 5.170029 5.126763 5.079585 5.027715 4.970116 4.905363 4.831425 4.745257 4.641997 4.513141 4.34167 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.14063e-10 7.595178e-10 7.257129000000001e-10 7.011519e-10 6.818498e-10 6.659471e-10 6.524239e-10 6.406596999999999e-10 6.302494000000001e-10 6.209131e-10 6.124498e-10 6.047102e-10 5.975800999999999e-10 5.909705e-10 5.848107e-10 5.790431000000001e-10 5.73621e-10 5.685051e-10 5.636628000000001e-10 5.590663000000001e-10 5.546918e-10 5.505188999999999e-10 5.465298e-10 5.42709e-10 5.401079000000001e-10 5.373703e-10 5.344811e-10 5.314227e-10 5.281738e-10 5.247091000000001e-10 5.209981e-10 5.170029000000001e-10 5.126763000000001e-10 5.079585e-10 5.027715e-10 4.970116e-10 4.905363e-10 4.831425e-10 4.745257e-10 4.641997e-10 4.5131410000000003e-10 4.34167e-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" [ 1.37665 1.93176 2.3512 2.68991 2.97274 3.21362 3.42135 3.60194 3.75973 3.89797 4.0192 4.12542 4.21826 4.29907 4.36898 4.42893 4.47976 4.52217 4.55679 4.58415 4.60475 4.619 4.6273 4.63 4.6287 4.62444 4.61655 4.60422 4.58639 4.5617 4.52836 4.48398 4.42531 4.34786 4.24519 4.10784 3.92132 3.6624 3.29147 2.73526 1.84195 0.23792 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.20563644502432e-19 3.095020708996608e-19 3.76703767082496e-19 4.3097109140561277e-19 4.762854527716992e-19 5.148786832135296e-19 5.48160698157408e-19 5.770944057524352e-19 6.023751506520384e-19 6.245236402579776e-19 6.43946827431936e-19 6.609651474980737e-19 6.758397552455808e-19 6.887869445182657e-19 6.999877612742784e-19 7.095928101159745e-19 7.177366738795008e-19 7.245315049283137e-19 7.300782403895233e-19 7.344617956240321e-19 7.3776227946288e-19 7.4004538114752005e-19 7.41375187742784e-19 7.418077754304e-19 7.415994924696961e-19 7.409169652292352e-19 7.39652847875424e-19 7.376773641019776e-19 7.348206831870912e-19 7.30864909110336e-19 7.255232522565888e-19 7.184127924134784e-19 7.090128221792448e-19 6.966039642511488e-19 6.801544168853952e-19 6.581485209987073e-19 6.282647226675457e-19 5.86781165601792e-19 5.273516282064577e-19 4.382369623809408e-19 2.95112922668256e-19 3.81189861620736e-20 ] } }