{ "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" [ "Ge" "Ge" "Ge" "Ge" ] } "a" { "source-value" [ 6.77541 6.321432 6.040075 5.835654 5.675004 5.542647 5.430093 5.332181 5.245535 5.16783 5.09739 5.032973 4.97363 4.918619 4.867351 4.819348 4.774219 4.73164 4.691338 4.653081 4.616673 4.581942 4.548741 4.51694 4.484791 4.451661 4.417489 4.382207 4.34574 4.308006 4.268913 4.228361 4.186236 4.142411 4.096742 4.049069 3.999207 3.946945 3.89204 3.834212 3.77313 3.708407 3.639582 3.566098 3.48728 3.40229 3.310082 3.209312 3.098227 2.974473 2.834782 2.674436 2.486246 2.25847 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.77541e-10 6.321432e-10 6.040075e-10 5.835654e-10 5.675004000000001e-10 5.542647e-10 5.430093000000001e-10 5.332181000000001e-10 5.245535000000001e-10 5.167830000000001e-10 5.09739e-10 5.032973000000001e-10 4.973630000000001e-10 4.918619e-10 4.867351e-10 4.819348e-10 4.774219000000001e-10 4.73164e-10 4.691338e-10 4.6530810000000003e-10 4.616673e-10 4.581942e-10 4.5487409999999996e-10 4.51694e-10 4.4847910000000006e-10 4.4516609999999997e-10 4.417489e-10 4.3822070000000003e-10 4.34574e-10 4.308006e-10 4.2689130000000006e-10 4.2283609999999996e-10 4.186236e-10 4.142411e-10 4.096742e-10 4.0490690000000005e-10 3.999207e-10 3.946945e-10 3.8920400000000004e-10 3.8342120000000003e-10 3.7731300000000004e-10 3.708407e-10 3.639582e-10 3.566098e-10 3.4872800000000003e-10 3.40229e-10 3.310082e-10 3.209312e-10 3.098227e-10 2.974473e-10 2.8347820000000003e-10 2.674436e-10 2.486246e-10 2.25847e-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 0 0 0 0 0 0 0 0 0 0 0 7.4614e-07 0.0232874 0.341411 1.17017 2.34903 3.64743 5.01896 6.30777 7.32713 8.05335 8.48573 8.62536 8.48325 8.0498 7.33194 6.35209 5.14476 3.7546 2.23112 0.624291 -1.01906 -2.65738 -4.25593 -5.78732 -7.23191 -8.57792 -9.82212 -10.9715 -12.0467 -13.0879 -14.1635 -15.3462 -16.6661 -18.4225 -22.6791 -30.5926 -40.1014 -49.1686 -57.403 -83.7511 -118.824 -163.252 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 0.0 1.19544807369276e-25 3.73105281466116e-21 5.47000726790574e-20 1.8748190318077799e-19 3.7635609785650195e-19 5.843827120150619e-19 8.041260438980639e-19 1.010616170664618e-18 1.1739356480280419e-18 1.2902889195423899e-18 1.3595638328432819e-18 1.381935025183824e-18 1.3591664930380499e-18 1.2897201468373198e-18 1.174706294988996e-18 1.017717017506506e-18 8.242814259537839e-19 6.0155323900164e-19 3.57464833165008e-19 1.000224453016494e-19 -1.63271412064404e-19 -4.2575921436589195e-19 -6.81875160193962e-19 -9.27230887748088e-19 -1.1586797221190938e-18 -1.374334299232128e-18 -1.573677116034408e-18 -1.7578280939931e-18 -1.93009412568078e-18 -2.0969127568128596e-18 -2.2692428755659e-18 -2.45873230606908e-18 -2.67020359999074e-18 -2.9516099039864996e-18 -3.6335924100149396e-18 -4.9014748893308395e-18 -6.424952607068759e-18 -7.87767820464924e-18 -9.1969745321502e-18 -1.3418405549179739e-17 -1.9037703635841597e-17 -2.61558539853768e-17 ] } }