{ "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" [ "Mg" "Mg" ] } "a" { "source-value" [ 5.39207 5.030781 4.806868 4.644184 4.516333 4.410999 4.321425 4.243504 4.174549 4.112708 4.05665 4.005385 3.958158 3.914379 3.873578 3.835375 3.799461 3.765575 3.733501 3.703056 3.67408 3.64644 3.620018 3.59471 3.577481 3.559348 3.540212 3.519954 3.498434 3.475486 3.450905 3.424443 3.395785 3.364536 3.330179 3.292028 3.249138 3.200165 3.14309 3.074695 2.989346 2.87577 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.39207e-10 5.030781e-10 4.806868e-10 4.6441840000000004e-10 4.5163330000000004e-10 4.4109990000000003e-10 4.321425e-10 4.243504e-10 4.174549e-10 4.1127079999999996e-10 4.0566500000000007e-10 4.0053850000000003e-10 3.9581580000000004e-10 3.914379e-10 3.873578e-10 3.8353750000000003e-10 3.799461e-10 3.765575e-10 3.733501e-10 3.7030560000000003e-10 3.67408e-10 3.6464400000000003e-10 3.620018e-10 3.59471e-10 3.5774810000000005e-10 3.559348e-10 3.540212e-10 3.519954e-10 3.498434e-10 3.475486e-10 3.450905e-10 3.4244430000000004e-10 3.395785e-10 3.364536e-10 3.330179e-10 3.292028e-10 3.249138e-10 3.200165e-10 3.14309e-10 3.074695e-10 2.989346e-10 2.8757700000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.247345 0.408139 0.54948 0.675966 0.790623 0.894079 0.986283 1.06808 1.14029 1.20398 1.25995 1.30894 1.35161 1.38853 1.42016 1.44695 1.46926 1.4875 1.50206 1.51337 1.52185 1.52777 1.53125 1.53238 1.53183 1.53005 1.52672 1.52152 1.51401 1.50351 1.48912 1.46965 1.44345 1.40816 1.36033 1.29474 1.20317 1.07176 0.876007 0.567721 0.0408316 -0.988267 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.9629037627177603e-20 6.539107638366912e-20 8.80364009597184e-20 1.0830169216556928e-19 1.2667176864667585e-19 1.4324724709482431e-19 1.5801995640924864e-19 1.711252805144064e-19 1.8269459789320322e-19 1.9289886079107842e-19 2.01866243337696e-19 2.0971530660299522e-19 2.165517942439488e-19 2.2246703032794244e-19 2.2753471497953284e-19 2.3182694614665603e-19 2.354014021876608e-19 2.38323772344e-19 2.406565415038848e-19 2.424686032620096e-19 2.43827249036448e-19 2.447757375959616e-19 2.4533329506e-19 2.455143410181504e-19 2.4542622130400644e-19 2.45141033865504e-19 2.446075090507776e-19 2.4377437720796163e-19 2.4257114256574085e-19 2.408888571139008e-19 2.385833249565696e-19 2.35463887075872e-19 2.3126618432937597e-19 2.256121030345728e-19 2.1794889225728644e-19 2.074402158014592e-19 1.9276908448479363e-19 1.717148815108608e-19 1.4035179350571455e-19 9.09589313337197e-20 6.541943490985729e-21 -1.5833782825081537e-19 ] } }