{ "short-name" { "source-value" [ "diamond" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 9.146330000000001e-10 8.533491e-10 8.153679000000001e-10 7.877724e-10 7.660858e-10 7.482184e-10 7.330244000000001e-10 7.198069000000001e-10 7.081104e-10 6.976207e-10 6.881118e-10 6.79416e-10 6.71405e-10 6.639789000000001e-10 6.57058e-10 6.50578e-10 6.444859000000001e-10 6.387381e-10 6.332975e-10 6.281332e-10 6.232182e-10 6.185298000000001e-10 6.140479e-10 6.09755e-10 6.068325e-10 6.037568e-10 6.005107e-10 5.970744e-10 5.934241000000001e-10 5.895315e-10 5.85362e-10 5.808732000000001e-10 5.760122e-10 5.707115e-10 5.648837000000001e-10 5.584122e-10 5.511370000000001e-10 5.428298e-10 5.331485e-10 5.215468e-10 5.070695e-10 4.87804e-10 ] "source-value" [ 9.14633 8.533491 8.153679 7.877724 7.660858 7.482184 7.330244 7.198069 7.081104 6.976207 6.881118 6.79416 6.71405 6.639789 6.57058 6.50578 6.444859 6.387381 6.332975 6.281332 6.232182 6.185298 6.140479 6.09755 6.068325 6.037568 6.005107 5.970744 5.934241 5.895315 5.85362 5.808732 5.760122 5.707115 5.648837 5.584122 5.51137 5.428298 5.331485 5.215468 5.070695 4.87804 ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "cohesive-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" [ 2.674978064321472e-19 3.377901013165056e-19 3.7952199575848325e-19 4.095692161049664e-19 4.3327982791618566e-19 4.527078216200064e-19 4.685757788724096e-19 4.81478107199712e-19 4.92453017052192e-19 5.034103029618432e-19 5.141480906744448e-19 5.242065554998273e-19 5.333149295890752e-19 5.413097909268672e-19 5.481126328587841e-19 5.537907468028993e-19 5.584851243018433e-19 5.62307917719072e-19 5.653552576518337e-19 5.677056507545472e-19 5.69429592798528e-19 5.705815577888832e-19 5.712096110242368e-19 5.713762373928e-19 5.713233655643137e-19 5.712048044943744e-19 5.710590064218816e-19 5.708571321676608e-19 5.7053509466688e-19 5.7000317202877445e-19 5.691379966535424e-19 5.677649312895168e-19 5.65632434207232e-19 5.623784134903872e-19 5.574581290879104e-19 5.500720948660224e-19 5.392109395536192e-19 5.234679520776385e-19 5.005888699326144e-19 4.666387473378624e-19 4.137508970852544e-19 3.26579671500768e-19 ] "source-value" [ 1.66959 2.10832 2.36879 2.55633 2.70432 2.82558 2.92462 3.00515 3.07365 3.14204 3.20906 3.27184 3.32869 3.37859 3.42105 3.45649 3.48579 3.50965 3.52867 3.54334 3.5541 3.56129 3.56521 3.56625 3.56592 3.56518 3.56427 3.56301 3.561 3.55768 3.55228 3.54371 3.5304 3.51009 3.47938 3.43328 3.36549 3.26723 3.12443 2.91253 2.58243 2.03835 ] } "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 ] ] } "species" { "source-value" [ "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" ] } "instance-id" 1 }