{ "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 5.622386 5.580853 5.538013 5.493781 5.448064 5.400758 5.351749 5.300911 5.2481 5.193158 5.135906 5.07614 5.013629 4.948111 4.879279 4.806782 4.730206 4.649066 4.562783 4.470659 4.371848 4.2653 4.149702 4.023371 3.884109 3.728963 3.553839 ] "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 5.622386e-10 5.580853e-10 5.538013000000001e-10 5.493781e-10 5.448064e-10 5.400758e-10 5.351749e-10 5.300911e-10 5.2481e-10 5.193158e-10 5.135906000000001e-10 5.07614e-10 5.013629e-10 4.948111e-10 4.879279e-10 4.806782e-10 4.730206e-10 4.6490660000000005e-10 4.562783e-10 4.470659000000001e-10 4.371848e-10 4.2653e-10 4.149702e-10 4.0233710000000004e-10 3.8841090000000003e-10 3.728963e-10 3.553839e-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 2.36904 2.36558 2.35908 2.34886 2.33416 2.31397 2.28683 2.25074 2.20304 2.14052 2.05979 1.9575 1.83091 1.68184 1.5135 1.32887 1.13258 0.931132 0.731637 0.5475 0.397993 0.276317 0.121899 0.141291 1.18606 3.98703 12.204 ] "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 3.79562053301136e-19 3.79007700185772e-19 3.77966285373672e-19 3.76328860853724e-19 3.7397366120174394e-19 3.7073886657769797e-19 3.66390559193022e-19 3.6060830372091597e-19 3.52965921176736e-19 3.4294911286096796e-19 3.3001474089468596e-19 3.1362607610549997e-19 2.93344122095694e-19 2.6946047501265597e-19 2.4248943355589997e-19 2.12908446362358e-19 1.8145932121357198e-19 1.4918379335696878e-19 1.1722117059698578e-19 8.77191707115e-20 6.376550850955619e-20 4.427086409769779e-20 1.9530372950796598e-20 2.26373138794494e-20 1.9002776185220396e-19 6.387926305057019e-19 1.9552963641336e-18 ] } }