{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Si" "Si" ] } "a" { "source-value" [ 5.12784 4.784256 4.571316 4.416604 4.295019 4.194847 4.109662 4.035559 3.969984 3.911174 3.857863 3.80911 3.764197 3.722563 3.683762 3.647432 3.613277 3.581052 3.55055 3.521596 3.494041 3.467755 3.442628 3.41856 3.402175 3.384931 3.366732 3.347467 3.327002 3.305178 3.281802 3.256636 3.229383 3.199665 3.166992 3.13071 3.089922 3.043348 2.989071 2.924027 2.84286 2.73485 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.12784e-10 4.784256e-10 4.5713160000000005e-10 4.416604000000001e-10 4.295019e-10 4.1948470000000003e-10 4.109662e-10 4.0355590000000004e-10 3.9699840000000003e-10 3.911174e-10 3.8578630000000003e-10 3.80911e-10 3.764197e-10 3.722563e-10 3.6837620000000005e-10 3.647432e-10 3.613277e-10 3.5810520000000004e-10 3.55055e-10 3.5215960000000003e-10 3.494041e-10 3.4677550000000003e-10 3.442628e-10 3.41856e-10 3.402175e-10 3.384931e-10 3.3667319999999997e-10 3.347467e-10 3.327002e-10 3.3051780000000004e-10 3.281802e-10 3.256636e-10 3.229383e-10 3.199665e-10 3.166992e-10 3.1307100000000005e-10 3.089922e-10 3.043348e-10 2.989071e-10 2.9240270000000003e-10 2.84286e-10 2.73485e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.687044 1.108 1.44992 1.73639 1.98069 2.19134 2.37422 2.53362 2.67281 2.79434 2.99916 3.10384 3.19603 3.27681 3.34714 3.40782 3.45955 3.50293 3.53851 3.56678 3.58814 3.603 3.61168 3.61451 3.61314 3.60863 3.60028 3.58717 3.56815 3.64265 3.61117 3.56778 3.50877 3.42891 3.35813 3.21268 3.00987 2.72052 2.29358 1.63167 0.525219 -1.59072 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.1007658342609152e-19 1.7752116958464002e-19 2.323027926030336e-19 2.7820034625909124e-19 3.173415211052352e-19 3.510913716223872e-19 3.8039197766357764e-19 4.059306729991296e-19 4.2823136938404486e-19 4.477026218566272e-19 4.805184034038528e-19 4.9728998827038725e-19 5.120604545375424e-19 5.250028372803648e-19 5.362709454544512e-19 5.459929531894656e-19 5.54281012848864e-19 5.612312550298944e-19 5.669317994467008e-19 5.7146115275370245e-19 5.748834020157313e-19 5.772642364742401e-19 5.786549257810944e-19 5.791083417647809e-19 5.788888435677312e-19 5.781662619117504e-19 5.768284444333824e-19 5.747279908835137e-19 5.71680650950752e-19 5.83616866775712e-19 5.785732147734336e-19 5.716213704157824e-19 5.621669261764417e-19 5.493719436827328e-19 5.380317375607104e-19 5.147280786111745e-19 4.822343345647296e-19 4.358753540418817e-19 3.674720253934464e-19 2.614223526860736e-19 8.414936025999553e-20 -2.548614394238976e-19 ] } }