{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Fe" ] } "a" { "source-value" [ 3.48332 3.249924 3.105275 3.000179 2.917587 2.84954 2.791674 2.741336 2.696791 2.656841 2.620627 2.58751 2.557001 2.528719 2.502361 2.477682 2.454481 2.43259 2.41187 2.392202 2.373484 2.355628 2.338559 2.32221 2.31108 2.299366 2.287004 2.273917 2.260015 2.24519 2.229311 2.212216 2.193703 2.173516 2.151321 2.126675 2.098968 2.067331 2.030461 1.986277 1.931141 1.85777 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.48332e-10 3.249924e-10 3.105275e-10 3.000179e-10 2.9175870000000003e-10 2.84954e-10 2.7916740000000003e-10 2.741336e-10 2.696791e-10 2.656841e-10 2.620627e-10 2.58751e-10 2.5570010000000004e-10 2.528719e-10 2.502361e-10 2.477682e-10 2.454481e-10 2.43259e-10 2.41187e-10 2.3922020000000004e-10 2.373484e-10 2.3556279999999997e-10 2.338559e-10 2.32221e-10 2.31108e-10 2.299366e-10 2.2870040000000002e-10 2.273917e-10 2.260015e-10 2.24519e-10 2.2293110000000001e-10 2.2122160000000003e-10 2.1937030000000003e-10 2.173516e-10 2.1513209999999998e-10 2.126675e-10 2.0989680000000003e-10 2.067331e-10 2.0304609999999998e-10 1.986277e-10 1.931141e-10 1.85777e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.66559 2.14111 2.43937 2.62186 2.74389 2.8339 2.90633 2.98265 3.09755 3.23514 3.35178 3.43367 3.4881 3.52468 3.5504 3.56987 3.58576 3.59978 3.61314 3.62664 3.63948 3.64977 3.65617 3.6583 3.65724 3.6537 3.64707 3.63678 3.62258 3.60469 3.58388 3.56076 3.53377 3.49707 3.44026 3.35018 3.21289 3.01354 2.73304 2.34164 1.78358 0.84725 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.6685693798240595e-19 3.4304364128237394e-19 3.9083016156805797e-19 4.2006828296192394e-19 4.39619644426626e-19 4.5404083630926e-19 4.65645401669322e-19 4.7787321374001e-19 4.9628222326467e-19 5.18326571571876e-19 5.37014359830852e-19 5.50134584286678e-19 5.5885523170554e-19 5.64715993832712e-19 5.688367921353599e-19 5.7195623004175795e-19 5.74502088713184e-19 5.7674834035405195e-19 5.78888848337076e-19 5.81051786792976e-19 5.831089815910319e-19 5.84757621347418e-19 5.857830143931779e-19 5.8612427801622e-19 5.85954447293016e-19 5.8538727676458e-19 5.843250336562379e-19 5.826763938998519e-19 5.80401303079572e-19 5.77535009081346e-19 5.74200879505992e-19 5.70496647128184e-19 5.66172372393018e-19 5.602923841462379e-19 5.511904186884839e-19 5.36758011569412e-19 5.147617285612259e-19 4.82822337362436e-19 4.378812827787359e-19 3.75172089323976e-19 2.8576102008697195e-19 1.3574441531565e-19 ] } }