{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" [ 6.39188 5.9636 5.698169 5.505319 5.353762 5.228897 5.122714 5.030344 4.948604 4.875296 4.808844 4.748074 4.692089 4.640192 4.591826 4.54654 4.503966 4.463797 4.425776 4.389685 4.355337 4.322572 4.29125 4.26125 4.240826 4.219331 4.196646 4.172632 4.147122 4.119919 4.09078 4.059411 4.02544 3.988396 3.947669 3.902443 3.851601 3.793546 3.725888 3.64481 3.543636 3.409 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.39188e-10 5.9636e-10 5.698169e-10 5.505319e-10 5.353762e-10 5.228897e-10 5.122714000000001e-10 5.030344e-10 4.948604e-10 4.875295999999999e-10 4.808844e-10 4.748074e-10 4.692089e-10 4.640192e-10 4.591826e-10 4.5465400000000006e-10 4.503966e-10 4.4637969999999997e-10 4.425776e-10 4.389685e-10 4.355337e-10 4.322572e-10 4.29125e-10 4.2612500000000007e-10 4.2408260000000005e-10 4.2193310000000007e-10 4.1966460000000005e-10 4.1726320000000005e-10 4.1471220000000004e-10 4.1199190000000003e-10 4.09078e-10 4.059411e-10 4.0254399999999997e-10 3.988396e-10 3.947669e-10 3.902443e-10 3.851601e-10 3.793546e-10 3.725888e-10 3.6448100000000003e-10 3.543636e-10 3.409e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 2.78406e-248 6.42854e-09 0.000188094 0.00646335 0.0390528 0.116399 0.242254 0.408981 0.603951 0.813796 1.02656 1.23247 1.42403 1.5958 1.74405 1.86645 1.96171 2.02936 2.06952 2.08273 2.07629 2.05506 2.01567 1.95393 1.86463 1.74116 1.5751 1.35554 1.06814 0.693693 0.205974 -0.431896 -1.27331 -2.39888 -3.93662 -6.10433 -9.31165 -14.6151 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 4.460555842904448e-267 1.0299656493877632e-27 3.013598093127552e-23 1.035542826204768e-21 6.256948313677824e-21 1.864917564844992e-20 3.8813369509528323e-20 6.552597965514048e-20 9.676361723087809e-20 1.303844925300557e-19 1.6447304318484479e-19 1.974634619837376e-19 2.281547573317824e-19 2.55675345147264e-19 2.7942761355062403e-19 2.99038255389216e-19 3.143005898789568e-19 3.251393147186688e-19 3.315736560278016e-19 3.3369013134387843e-19 3.3265832960008325e-19 3.2925690863412486e-19 3.229459349247936e-19 3.1305409646797443e-19 2.987466592442304e-19 2.789645845072128e-19 2.52358839542208e-19 2.1718144965592323e-19 1.7113489357413123e-19 1.1114187066126144e-19 3.300067272926592e-20 -6.919736738170368e-20 -2.0400675130308481e-19 -3.8434294521047043e-19 -6.307160528973696e-19 -9.780214811648065e-19 -1.4918907931072322e-18 -2.341597153065408e-18 ] } }