{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Ti" ] } "a" { "source-value" [ 4.1601 3.881358 3.708605 3.58309 3.484451 3.403184 3.334076 3.273958 3.220757 3.173046 3.129796 3.090244 3.053808 3.020031 2.988552 2.959078 2.931369 2.905226 2.88048 2.856991 2.834636 2.813311 2.792926 2.7734 2.760107 2.746118 2.731353 2.715724 2.699121 2.681416 2.662451 2.642035 2.619925 2.595815 2.569308 2.539873 2.506783 2.468998 2.424964 2.372195 2.306347 2.21872 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1601e-10 3.881358e-10 3.708605e-10 3.58309e-10 3.484451e-10 3.4031840000000003e-10 3.334076e-10 3.273958e-10 3.220757e-10 3.173046e-10 3.129796e-10 3.0902440000000004e-10 3.0538080000000003e-10 3.020031e-10 2.988552e-10 2.959078e-10 2.9313690000000003e-10 2.905226e-10 2.88048e-10 2.856991e-10 2.8346360000000003e-10 2.8133110000000004e-10 2.7929260000000003e-10 2.7734e-10 2.7601070000000003e-10 2.746118e-10 2.731353e-10 2.715724e-10 2.699121e-10 2.681416e-10 2.662451e-10 2.642035e-10 2.619925e-10 2.595815e-10 2.569308e-10 2.5398730000000004e-10 2.506783e-10 2.4689980000000003e-10 2.4249640000000003e-10 2.3721950000000003e-10 2.3063470000000003e-10 2.21872e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.34962 1.77631 2.08583 2.32902 2.52794 2.69456 2.83627 2.95801 3.06328 3.15466 3.23412 3.30322 3.3632 3.41507 3.45968 3.49772 3.52981 3.55646 3.5781 3.59514 3.60791 3.61671 3.62182 3.62347 3.62268 3.62008 3.61529 3.60781 3.59703 3.58214 3.56211 3.53554 3.50055 3.45454 3.39384 3.31303 3.2039 3.05337 2.83929 2.52102 2.01525 1.1194 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.1623296109640962e-19 2.845962353293248e-19 3.341868060963264e-19 3.731501393375616e-19 4.0502063667851525e-19 4.3171610353428483e-19 4.544205484276416e-19 4.739254466092608e-19 4.907915598964224e-19 5.054322498572928e-19 5.181631452861696e-19 5.292341857358977e-19 5.38844041107456e-19 5.471545312395456e-19 5.543018411449344e-19 5.603965210104577e-19 5.655379057866048e-19 5.698077064810368e-19 5.732748166884481e-19 5.760049256502912e-19 5.780509051950529e-19 5.794608206213568e-19 5.802795328745857e-19 5.805438920170177e-19 5.804173200639744e-19 5.800007541425665e-19 5.792333115412032e-19 5.780348834288449e-19 5.763077370316225e-19 5.739220960432512e-19 5.707129362717888e-19 5.664559529903233e-19 5.60849936994144e-19 5.534783223618433e-19 5.437531102735872e-19 5.308059210009024e-19 5.13321367538112e-19 4.892038028652096e-19 4.549044057671232e-19 4.0391193045692164e-19 3.2287864350672e-19 1.79347650932352e-19 ] } }