{ "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" [ "Pb" "Pb" ] } "a" { "source-value" [ 5.89016 5.495497 5.2509 5.073188 4.933528 4.818463 4.720615 4.635496 4.560171 4.492618 4.431382 4.375381 4.323791 4.275968 4.231398 4.189667 4.150434 4.113419 4.078382 4.045124 4.013472 3.983279 3.954416 3.92677 3.90795 3.888142 3.867238 3.845108 3.821601 3.796533 3.769682 3.740775 3.70947 3.675335 3.637804 3.596129 3.549277 3.49578 3.433433 3.35872 3.265487 3.14142 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.89016e-10 5.495497e-10 5.2509e-10 5.073188e-10 4.933528e-10 4.818463e-10 4.720615e-10 4.635496e-10 4.5601710000000005e-10 4.492618e-10 4.4313820000000003e-10 4.3753810000000004e-10 4.3237910000000003e-10 4.275968e-10 4.2313980000000004e-10 4.1896670000000004e-10 4.150434e-10 4.1134190000000004e-10 4.0783820000000006e-10 4.045124000000001e-10 4.0134720000000005e-10 3.983279e-10 3.954416e-10 3.92677e-10 3.90795e-10 3.888142e-10 3.867238e-10 3.8451080000000005e-10 3.821601e-10 3.7965330000000005e-10 3.769682e-10 3.7407750000000005e-10 3.70947e-10 3.675335e-10 3.6378040000000003e-10 3.596129e-10 3.549277e-10 3.49578e-10 3.433433e-10 3.35872e-10 3.2654869999999997e-10 3.1414200000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.334256 0.531298 0.739464 0.894516 1.03177 1.1543 1.26424 1.36313 1.45217 1.53229 1.60428 1.66876 1.72627 1.77728 1.82218 1.86132 1.89502 1.92355 1.94716 1.96606 1.98047 1.99055 1.99649 1.99844 1.99749 1.99435 1.98851 1.97929 1.96584 1.94705 1.92141 1.88692 1.8408 1.77914 1.69625 1.58366 1.42812 1.20796 0.885358 0.388492 -0.436257 -1.98226 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.3553715297430394e-20 8.51233241290932e-20 1.184751942484176e-19 1.4331726339391439e-19 1.65307778566218e-19 1.8493924886262e-19 2.0255357877681599e-19 2.1839750351044195e-19 2.3266328425957796e-19 2.4549992345118596e-19 2.5703399303935197e-19 2.6736482797538396e-19 2.76578945797518e-19 2.8475164880755195e-19 2.91945421894212e-19 2.98216341239688e-19 3.03615676496268e-19 3.0818668643307e-19 3.11969425465944e-19 3.14997539304204e-19 3.17306275833798e-19 3.1892126988087e-19 3.19872962801466e-19 3.2018538724509596e-19 3.20033180464866e-19 3.1953009700179e-19 3.1859442584753398e-19 3.17117218990986e-19 3.14962291418256e-19 3.1195180152296996e-19 3.07843820633394e-19 3.02317913422728e-19 2.9492867478672e-19 2.8504965366147596e-19 2.7176921154225e-19 2.53730304820044e-19 2.2881004945480798e-19 1.9353652868066397e-19 1.4184999003249719e-19 6.22432804895928e-20 -6.98960771818938e-20 -3.17593065451284e-19 ] } }