{ "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" [ "Na" "Na" "Na" "Na" ] } "a" { "source-value" [ 7.94788 7.415343 7.085298 6.845503 6.657053 6.501792 6.369761 6.254905 6.153266 6.062114 5.979485 5.903921 5.834309 5.769778 5.709638 5.653328 5.60039 5.550443 5.503167 5.45829 5.415581 5.37484 5.335894 5.29859 5.273195 5.246467 5.21826 5.188399 5.156679 5.122853 5.086621 5.047615 5.005374 4.959313 4.908671 4.852436 4.789216 4.717029 4.632901 4.532086 4.406281 4.23887 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.94788e-10 7.415343e-10 7.085298e-10 6.845503e-10 6.657053e-10 6.501792e-10 6.369761e-10 6.254905e-10 6.153266e-10 6.062114000000001e-10 5.979485e-10 5.903921e-10 5.834309e-10 5.769778e-10 5.709638e-10 5.653328e-10 5.600390000000001e-10 5.550443e-10 5.503167000000001e-10 5.45829e-10 5.415581000000001e-10 5.37484e-10 5.335894e-10 5.29859e-10 5.273195e-10 5.246467e-10 5.21826e-10 5.188399000000001e-10 5.156679e-10 5.122853e-10 5.086621e-10 5.047615000000001e-10 5.005374e-10 4.959313e-10 4.908671e-10 4.852436e-10 4.789216e-10 4.717029e-10 4.6329010000000004e-10 4.532086e-10 4.406281e-10 4.2388700000000005e-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 0.849177 0.889556 0.923779 0.953139 0.978518 1.00056 1.01974 1.03644 1.05096 1.06353 1.07437 1.08362 1.09144 1.09795 1.10324 1.10742 1.11056 1.11272 1.11398 1.11439 1.11419 1.11355 1.11236 1.1105 1.10782 1.10411 1.09911 1.09245 1.08367 1.0721 1.05677 1.0363 1.0085 0.969597 0.914526 0.832093 0.699939 0.463098 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 1.3605315363210817e-19 1.425225826092365e-19 1.4800571165860033e-19 1.5270970221726913e-19 1.5677586626319745e-19 1.6030738397076478e-19 1.6338035872945923e-19 1.6605599368619522e-19 1.683823541395968e-19 1.7039629015194242e-19 1.7213304960888963e-19 1.7361506298312961e-19 1.748679651005952e-19 1.75910982080736e-19 1.767585335131392e-19 1.7742824334063362e-19 1.779313267995648e-19 1.782773969496576e-19 1.784792712038784e-19 1.785449604453312e-19 1.7851291691291522e-19 1.7841037760918401e-19 1.782197185913088e-19 1.7792171373984003e-19 1.774923304054656e-19 1.768979228791488e-19 1.7609683456874882e-19 1.75029784939296e-19 1.736230738662336e-19 1.7176935551596803e-19 1.693132187562816e-19 1.6603356321350402e-19 1.6157951220768e-19 1.5534656449978177e-19 1.4652321763137408e-19 1.3331599509313344e-19 1.1214259017861312e-19 7.419647887392385e-20 ] } }