{ "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" [ "V" "V" "V" "V" "V" "V" "V" "V" ] } "a" { "source-value" [ 7.92123 7.390478 7.06154 6.822548 6.63473 6.479989 6.3484 6.23393 6.132632 6.041785 5.959433 5.884122 5.814743 5.750429 5.69049 5.634369 5.581609 5.531829 5.484711 5.439985 5.397419 5.356815 5.317998 5.28082 5.25551 5.228872 5.200759 5.170999 5.139386 5.105674 5.069564 5.030688 4.988589 4.942683 4.892211 4.836165 4.773157 4.701212 4.617367 4.516891 4.391509 4.22466 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.921230000000001e-10 7.390478e-10 7.06154e-10 6.822548000000001e-10 6.63473e-10 6.479989e-10 6.348400000000001e-10 6.23393e-10 6.132632e-10 6.041785e-10 5.959433e-10 5.884122e-10 5.814743e-10 5.750429e-10 5.69049e-10 5.634369e-10 5.581609e-10 5.531829e-10 5.484711e-10 5.439985e-10 5.397419e-10 5.356815e-10 5.317998e-10 5.28082e-10 5.25551e-10 5.228872e-10 5.200759e-10 5.170999000000001e-10 5.139386000000001e-10 5.105674e-10 5.069564e-10 5.030687999999999e-10 4.988589e-10 4.942683e-10 4.892211e-10 4.836165000000001e-10 4.773157e-10 4.701212e-10 4.617367e-10 4.5168910000000004e-10 4.391509e-10 4.22466e-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" [ 0.768834 0.986584 1.15794 1.34849 1.56765 1.79032 1.99533 2.17408 2.32592 2.45348 2.62344 2.71028 2.77991 2.83816 2.88676 2.92711 2.96033 2.9873 3.00879 3.0254 3.03764 3.04596 3.05072 3.05224 3.05152 3.04918 3.04489 3.03826 3.02878 3.01582 2.99855 2.97586 2.94629 2.90784 2.85767 2.79169 2.70372 2.58403 2.41635 2.17115 1.78872 1.12617 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.2318078600761474e-19 1.5806818192553473e-19 1.855224396289152e-19 2.1605191513825922e-19 2.51165217959712e-19 2.868408847750656e-19 3.196871076780864e-19 3.4832601477488643e-19 3.726534645851136e-19 3.930908295600384e-19 4.2032142340715523e-19 4.342347251821824e-19 4.453906809928128e-19 4.547233598089728e-19 4.625099381860608e-19 4.689747208509888e-19 4.742971515852864e-19 4.78618221931584e-19 4.820612994896832e-19 4.84722514856832e-19 4.866835790406912e-19 4.880165899891968e-19 4.887792260606976e-19 4.890227569070592e-19 4.889074001903616e-19 4.885324908610944e-19 4.878451570907712e-19 4.867829139911808e-19 4.852640505546624e-19 4.831876296541057e-19 4.80420670629984e-19 4.767853318773888e-19 4.720476956096832e-19 4.658873265027073e-19 4.5784920639615365e-19 4.472780450521152e-19 4.3318369731893763e-19 4.140072453445824e-19 3.87141947767008e-19 3.47856577024992e-19 2.865845365157376e-19 1.804323245046336e-19 ] } }