{ "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" [ "Ni" "Ni" ] } "a" { "source-value" [ 4.13554 3.858444 3.686711 3.561938 3.463882 3.383094 3.314394 3.254631 3.201745 3.154316 3.111321 3.072003 3.035782 3.002204 2.970911 2.941612 2.914066 2.888077 2.863478 2.840127 2.817904 2.796705 2.77644 2.75703 2.743816 2.729908 2.715231 2.699694 2.683189 2.665588 2.646735 2.626439 2.604459 2.580492 2.554141 2.52488 2.491985 2.454423 2.410648 2.358191 2.29273 2.20562 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.13554e-10 3.858444e-10 3.686711e-10 3.561938e-10 3.4638820000000003e-10 3.383094e-10 3.314394e-10 3.254631e-10 3.201745e-10 3.154316e-10 3.111321e-10 3.0720030000000003e-10 3.0357820000000005e-10 3.002204e-10 2.970911e-10 2.941612e-10 2.9140660000000003e-10 2.888077e-10 2.863478e-10 2.840127e-10 2.817904e-10 2.7967050000000003e-10 2.77644e-10 2.75703e-10 2.743816e-10 2.729908e-10 2.715231e-10 2.699694e-10 2.683189e-10 2.6655880000000004e-10 2.646735e-10 2.626439e-10 2.604459e-10 2.580492e-10 2.554141e-10 2.52488e-10 2.491985e-10 2.454423e-10 2.410648e-10 2.3581910000000004e-10 2.2927300000000003e-10 2.2056200000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.54998 2.01013 2.36298 2.67771 2.97609 3.25095 3.48728 3.66887 3.80271 3.91174 3.99798 4.06448 4.11538 4.1555 4.18959 4.21996 4.24543 4.26224 4.27013 4.27581 4.28293 4.28927 4.29316 4.29445 4.2938 4.29158 4.28737 4.28061 4.27053 4.25604 4.23559 4.20693 4.16637 4.10753 4.01887 3.87866 3.6439 3.22379 2.40866 0.651596 -3.77612 -18.0099 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.48334173916732e-19 3.22058331730242e-19 3.78591134260932e-19 4.2901643946281396e-19 4.76822185868106e-19 5.208596128302299e-19 5.58723853221552e-19 5.87817778718358e-19 6.092613107878139e-19 6.26729842628316e-19 6.40547013919932e-19 6.512014885360319e-19 6.593565676030919e-19 6.657845002587e-19 6.71246320404006e-19 6.76112130841464e-19 6.801928747282619e-19 6.82886133650016e-19 6.84150251014242e-19 6.850602873423539e-19 6.862010371057621e-19 6.87216817091718e-19 6.87840063802344e-19 6.8804674458813e-19 6.8794260310692e-19 6.875869198941719e-19 6.86912403531258e-19 6.85829332126674e-19 6.842143380796019e-19 6.818927841369359e-19 6.786163329204059e-19 6.740244946873619e-19 6.675260662598579e-19 6.580988589454019e-19 6.438939609083579e-19 6.21429842323044e-19 5.8381714366326e-19 5.1650810109228595e-19 3.8590987712504394e-19 1.0439718860078638e-19 -6.05001123118008e-19 -2.8855040960676595e-18 ] } }