{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" ] } "a" { "source-value" [ 7.36368 6.870286 6.5645 6.342331 6.167732 6.023883 5.901557 5.795143 5.700975 5.616523 5.539967 5.469958 5.405462 5.345675 5.289955 5.237784 5.188737 5.142461 5.09866 5.057082 5.017512 4.979766 4.943682 4.90912 4.885591 4.860828 4.834695 4.807029 4.777641 4.746302 4.712733 4.676594 4.637459 4.594783 4.547864 4.495763 4.43719 4.370309 4.292366 4.198961 4.082405 3.9273 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.36368e-10 6.870286e-10 6.5645e-10 6.342330999999999e-10 6.167732e-10 6.023883e-10 5.901557e-10 5.795143e-10 5.700975e-10 5.616523e-10 5.539967e-10 5.469958000000001e-10 5.405462e-10 5.345675e-10 5.289955e-10 5.237784e-10 5.188737e-10 5.142461000000001e-10 5.09866e-10 5.057082e-10 5.017512e-10 4.979766e-10 4.943682e-10 4.90912e-10 4.885591e-10 4.860828e-10 4.834695e-10 4.807029e-10 4.777641e-10 4.746302e-10 4.712733e-10 4.676594e-10 4.637459e-10 4.594783e-10 4.547864e-10 4.495763e-10 4.4371900000000004e-10 4.370309e-10 4.2923660000000006e-10 4.1989609999999996e-10 4.082405e-10 3.9273e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.282771 0.800294 1.01282 1.12895 1.20696 1.26525 1.31343 1.3655 1.42332 1.48195 1.53736 1.589 1.64465 1.70383 1.76433 1.82287 1.87645 1.92282 1.96064 1.98945 2.00961 2.0221 2.02833 2.03 2.02908 2.02529 2.01665 2.00058 1.97365 1.93123 1.86692 1.7717 1.63248 1.42968 1.13304 0.693716 -0.175654 -2.39472 -8.22488 -23.0257 -46.7291 -80.7742 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 4.5304908524023684e-20 1.282212336566515e-19 1.6227165250786563e-19 1.80877729605216e-19 1.9337630942407682e-19 2.0271539694672e-19 2.1043468390573444e-19 2.1877721757024e-19 2.280410027917056e-19 2.3743456431945603e-19 2.4631222497530883e-19 2.5458586504512e-19 2.63501977939872e-19 2.729836591817664e-19 2.8267682773760643e-19 2.9205596967576962e-19 3.00640432010016e-19 3.080697250006656e-19 3.1412915698053123e-19 3.18745027825056e-19 3.219750158925888e-19 3.23976134491968e-19 3.249742905267264e-19 3.252418540224e-19 3.250944537732864e-19 3.2448722883400324e-19 3.23102948233632e-19 3.205282504040064e-19 3.16213588764192e-19 3.094171555387584e-19 2.9911355769039362e-19 2.83857631907136e-19 2.615521289923584e-19 2.290599871225344e-19 1.8153301984312323e-19 1.1114555566748928e-19 -2.8142873215000324e-20 -3.836764397362176e-19 -1.3177710444885506e-18 -3.689123821755456e-18 -7.486827153102528e-18 -1.2941453480382336e-17 ] } }