{ "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" [ "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" ] } "a" { "source-value" [ 8.49404 7.924907 7.572182 7.315907 7.114507 6.948576 6.807472 6.684723 6.5761 6.478683 6.390376 6.30962 6.235223 6.166258 6.101985 6.041806 5.98523 5.931851 5.881326 5.833365 5.787721 5.74418 5.702557 5.66269 5.635549 5.606985 5.57684 5.544927 5.511028 5.474877 5.436156 5.394469 5.349326 5.300099 5.245977 5.185878 5.118314 5.041166 4.951258 4.843514 4.709065 4.53015 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 8.49404e-10 7.924907e-10 7.572182e-10 7.315907000000001e-10 7.114507e-10 6.948576000000001e-10 6.807472e-10 6.684723e-10 6.576100000000001e-10 6.478683e-10 6.390376e-10 6.30962e-10 6.235223e-10 6.166258e-10 6.101985000000001e-10 6.041806000000001e-10 5.985229999999999e-10 5.931851e-10 5.881326e-10 5.833365e-10 5.787721e-10 5.744180000000001e-10 5.702557e-10 5.662689999999999e-10 5.635549e-10 5.606985e-10 5.57684e-10 5.544927e-10 5.511028e-10 5.474877e-10 5.436156000000001e-10 5.394469e-10 5.349325999999999e-10 5.300099000000001e-10 5.245977e-10 5.185878e-10 5.118314e-10 5.041166e-10 4.951258e-10 4.843514e-10 4.709065e-10 4.53015e-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" [ 0.36585 0.616486 0.874758 1.12885 1.38845 1.59888 1.75567 1.87173 1.96214 2.03766 2.10275 2.15844 2.20533 2.24422 2.27604 2.30167 2.32191 2.33743 2.34886 2.35701 2.36275 2.3667 2.36919 2.37007 2.36961 2.36806 2.3651 2.36034 2.35329 2.34331 2.32958 2.31087 2.28531 2.25009 2.20088 2.13116 2.03163 1.88892 1.68929 1.42299 1.07918 0.662215 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.861563215489e-20 9.877194643881239e-20 1.401516828004572e-19 1.8086170932908997e-19 2.2245421474772997e-19 2.5616881765699197e-19 2.81289345101478e-19 2.9988420711568195e-19 3.1436948606367597e-19 3.2646912400364394e-19 3.3689769171435e-19 3.45820213389096e-19 3.5333281962592196e-19 3.59563684555548e-19 3.64661810604936e-19 3.68768189317878e-19 3.72010994825094e-19 3.7449757296106198e-19 3.76328860853724e-19 3.7763463481043394e-19 3.7855428419835e-19 3.7918714396877994e-19 3.79586085950646e-19 3.79727077494438e-19 3.79653377369274e-19 3.7940503999100396e-19 3.7893079570734e-19 3.7816815962955593e-19 3.7703862510258597e-19 3.7543965282185393e-19 3.73239864303372e-19 3.7024219182115795e-19 3.6614702834465396e-19 3.60504162239706e-19 3.5261985102379202e-19 3.4144947553154397e-19 3.2550301149334194e-19 3.02638348749528e-19 2.70654096604986e-19 2.27988132841566e-19 1.72903697988012e-19 1.0609853996843099e-19 ] } }