{ "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" [ 4.17214 3.892592 3.719339 3.593462 3.494537 3.413035 3.343727 3.283435 3.230081 3.182232 3.138857 3.099191 3.062648 3.028774 2.997204 2.967645 2.939856 2.913637 2.88882 2.865263 2.842843 2.821456 2.801012 2.78143 2.768099 2.754068 2.739261 2.723586 2.706935 2.689179 2.670159 2.649683 2.627509 2.60333 2.576746 2.547226 2.514039 2.476145 2.431983 2.379061 2.313021 2.22514 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.17214e-10 3.892592e-10 3.7193390000000003e-10 3.5934620000000003e-10 3.494537e-10 3.413035e-10 3.343727e-10 3.283435e-10 3.230081e-10 3.182232e-10 3.138857e-10 3.0991909999999997e-10 3.062648e-10 3.028774e-10 2.997204e-10 2.967645e-10 2.939856e-10 2.913637e-10 2.88882e-10 2.865263e-10 2.842843e-10 2.821456e-10 2.801012e-10 2.78143e-10 2.768099e-10 2.7540680000000005e-10 2.739261e-10 2.723586e-10 2.706935e-10 2.6891790000000004e-10 2.670159e-10 2.649683e-10 2.6275089999999997e-10 2.6033300000000005e-10 2.576746e-10 2.5472260000000003e-10 2.514039e-10 2.4761449999999997e-10 2.4319829999999997e-10 2.379061e-10 2.3130210000000002e-10 2.2251400000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.71355 2.2456 2.63576 2.95913 3.23633 3.47284 3.67521 3.85045 4.00462 4.14187 4.26412 4.37221 4.46691 4.54869 4.61773 4.67402 4.71825 4.75199 4.77763 4.79743 4.81275 4.82402 4.83099 4.83335 4.83216 4.82819 4.82075 4.80902 4.79207 4.76876 4.73763 4.69666 4.64298 4.57239 4.47849 4.351 4.17185 3.90567 3.47305 2.66424 0.804586 -4.93817 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.74540974857184e-19 3.5978478196684804e-19 4.222953050039808e-19 4.741048903907904e-19 5.185172263193664e-19 5.564103055779073e-19 5.888335538530369e-19 6.16910096955936e-19 6.416108539188096e-19 6.636007280392896e-19 6.831873372285696e-19 7.005052643227968e-19 7.156778769217729e-19 7.287804773266752e-19 7.398419047166784e-19 7.488605569151616e-19 7.5594698410896e-19 7.613527280275392e-19 7.654607088832705e-19 7.6863301859245445e-19 7.710875531755201e-19 7.728932062271616e-19 7.740099233318592e-19 7.74388037014368e-19 7.741973779964929e-19 7.735613138780353e-19 7.723692944721601e-19 7.704899412959617e-19 7.677742519237056e-19 7.640395782206209e-19 7.590520024000705e-19 7.524878847846528e-19 7.438874006841984e-19 7.325776359179713e-19 7.175331974486592e-19 6.971070477100801e-19 6.68404053548448e-19 6.257573162559937e-19 5.564439512869441e-19 4.2685830402001923e-19 1.2890888786229889e-19 -7.911820523535937e-19 ] } }