{ "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" [ 4.30824 4.019572 3.840667 3.710683 3.608532 3.52437 3.452801 3.390542 3.335448 3.286037 3.241247 3.200287 3.162553 3.127573 3.094974 3.06445 3.035755 3.00868 2.983053 2.958727 2.935577 2.913492 2.892381 2.87216 2.858394 2.843906 2.828616 2.81243 2.795236 2.7769 2.757261 2.736117 2.71322 2.688252 2.660801 2.630318 2.59605 2.55692 2.511318 2.45667 2.388477 2.29773 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.30824e-10 4.019572e-10 3.840667e-10 3.710683e-10 3.608532e-10 3.52437e-10 3.452801e-10 3.3905420000000003e-10 3.335448e-10 3.286037e-10 3.241247e-10 3.200287e-10 3.162553e-10 3.127573e-10 3.094974e-10 3.06445e-10 3.035755e-10 3.00868e-10 2.9830530000000003e-10 2.958727e-10 2.935577e-10 2.9134920000000004e-10 2.892381e-10 2.8721600000000003e-10 2.8583940000000003e-10 2.843906e-10 2.828616e-10 2.8124300000000003e-10 2.795236e-10 2.7769e-10 2.7572610000000004e-10 2.736117e-10 2.71322e-10 2.688252e-10 2.660801e-10 2.6303180000000003e-10 2.59605e-10 2.55692e-10 2.5113180000000005e-10 2.45667e-10 2.388477e-10 2.2977300000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.06829 1.4904 1.80842 2.06483 2.27871 2.46073 2.61761 2.75393 2.873 2.97729 3.06871 3.1488 3.21879 3.2797 3.33238 3.37756 3.41585 3.44781 3.47388 3.49449 3.51 3.52074 3.52699 3.52902 3.52804 3.52483 3.5189 3.50962 3.49619 3.4776 3.4525 3.41909 3.37494 3.31664 3.23937 3.13599 2.99563 2.80079 2.52167 2.10317 1.4311 0.22437 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.7115892763358598e-19 2.3878840553135995e-19 2.8974082684582797e-19 3.30822237918222e-19 3.6508959176621393e-19 3.9425241085828194e-19 4.1938735789247396e-19 4.412282297671619e-19 4.603053469482e-19 4.770144470641859e-19 4.916615458522139e-19 5.0449337851392e-19 5.15707012775286e-19 5.2546587065298e-19 5.339061371608919e-19 5.411447711933039e-19 5.4727950552489e-19 5.52400062047154e-19 5.56576936531992e-19 5.59879022574666e-19 5.623639985339999e-19 5.640847362389159e-19 5.65086096635166e-19 5.654113384918679e-19 5.65254325181736e-19 5.64740026482222e-19 5.6378993573826e-19 5.62303115821908e-19 5.60151392602446e-19 5.5717294623984e-19 5.531514828885e-19 5.47798610754306e-19 5.40725000915196e-19 5.31384311138976e-19 5.19004292288058e-19 5.024409902457659e-19 4.799528390109419e-19 4.48736029474086e-19 4.0401607526587794e-19 3.36964983132978e-19 2.2928749809173997e-19 3.5948037137058e-20 ] } }