{ "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" [ "Tm" "Tm" ] } "a" { "source-value" [ 6.27392 5.853544 5.593011 5.40372 5.254961 5.132399 5.028176 4.937511 4.857279 4.785324 4.720098 4.660449 4.605498 4.554559 4.507085 4.462635 4.420847 4.381419 4.3441 4.308675 4.274961 4.242801 4.212057 4.18261 4.162563 4.141465 4.119199 4.095628 4.070589 4.043887 4.015287 3.984496 3.951152 3.914792 3.874816 3.830425 3.780521 3.723538 3.65713 3.577548 3.478241 3.34609 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.273920000000001e-10 5.853544e-10 5.593011e-10 5.40372e-10 5.254961e-10 5.132399e-10 5.028176000000001e-10 4.937511e-10 4.857279e-10 4.785324e-10 4.720098e-10 4.660449e-10 4.605498e-10 4.5545590000000003e-10 4.5070850000000003e-10 4.462635e-10 4.4208470000000004e-10 4.3814190000000004e-10 4.3441e-10 4.308675e-10 4.274961e-10 4.2428010000000004e-10 4.212057e-10 4.1826100000000007e-10 4.162563e-10 4.1414650000000003e-10 4.1191990000000003e-10 4.095628e-10 4.070589e-10 4.043887e-10 4.015287e-10 3.9844960000000003e-10 3.951152e-10 3.914792e-10 3.8748160000000003e-10 3.830425e-10 3.780521e-10 3.7235380000000003e-10 3.65713e-10 3.577548e-10 3.478241e-10 3.34609e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.671771 1.00542 1.29935 1.56852 1.81875 2.05365 2.27461 2.48235 2.6775 2.86048 3.03174 3.19112 3.33861 3.47455 3.59893 3.71152 3.81173 3.89936 3.97417 4.03594 4.08445 4.11962 4.14093 4.1481 4.14449 4.13234 4.10931 4.0722 4.0167 3.93696 3.82473 3.66852 3.45171 3.1496 2.72441 2.1156 1.22217 -0.134745 -2.30127 -6.01364 -13.0929 -29.2173 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.0762957907314369e-19 1.610860418084736e-19 2.0817881922364802e-19 2.513046073257216e-19 2.9139587290800004e-19 3.2903100173059204e-19 3.6443269634378883e-19 3.97716313464288e-19 4.2898279021920007e-19 4.582994180265984e-19 4.857382948344193e-19 5.112737858167296e-19 5.349042887969088e-19 5.56684277780064e-19 5.766121505895745e-19 5.946510571631617e-19 6.107064690801984e-19 6.247463428082689e-19 6.367322261084736e-19 6.466288710951552e-19 6.544010298826561e-19 6.600358850580097e-19 6.634501234369345e-19 6.645988840740481e-19 6.640204983139392e-19 6.620738537196673e-19 6.583840409619648e-19 6.524383635221759e-19 6.435462832767361e-19 6.307705269024768e-19 6.127892986872385e-19 5.877616976937217e-19 5.530249063781568e-19 5.04621548487168e-19 4.364986007473728e-19 3.3895648589644804e-19 1.958132200643136e-19 -2.15885288769696e-20 -3.6870409921484166e-19 -9.634913413907711e-19 -2.0977138278472322e-18 -4.681127498289985e-18 ] } }