{ "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" [ 5.80401 5.41512 5.174101 4.998989 4.861371 4.74799 4.651573 4.567698 4.493476 4.426911 4.36657 4.311389 4.260554 4.21343 4.169512 4.128391 4.089733 4.053258 4.018734 3.985963 3.954774 3.925022 3.896581 3.86934 3.850795 3.831277 3.810678 3.788872 3.765708 3.741007 3.714548 3.686063 3.655217 3.62158 3.584598 3.543532 3.497365 3.44465 3.383215 3.309593 3.217724 3.09547 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.80401e-10 5.41512e-10 5.174101e-10 4.998989e-10 4.861371e-10 4.747989999999999e-10 4.651573e-10 4.567698e-10 4.4934760000000007e-10 4.426911e-10 4.3665700000000005e-10 4.3113890000000003e-10 4.260554e-10 4.21343e-10 4.169512e-10 4.1283909999999996e-10 4.089733e-10 4.053258e-10 4.0187340000000003e-10 3.985963e-10 3.954774e-10 3.925022e-10 3.896581e-10 3.86934e-10 3.850795e-10 3.8312770000000004e-10 3.810678e-10 3.788872e-10 3.765708e-10 3.7410070000000005e-10 3.714548e-10 3.686063e-10 3.655217e-10 3.62158e-10 3.584598e-10 3.543532e-10 3.497365e-10 3.44465e-10 3.383215e-10 3.309593e-10 3.217724e-10 3.09547e-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" [ 0.779619 1.11763 1.38871 1.61657 1.80623 1.96407 2.1018 2.22345 2.33366 2.44215 2.54659 2.64504 2.73652 2.8206 2.89713 2.96611 3.02766 3.08143 3.1243 3.15684 3.1802 3.19525 3.20359 3.20635 3.20498 3.20042 3.19185 3.17823 3.15821 3.13002 3.09131 3.03891 2.96843 2.87369 2.74573 2.57112 2.32936 1.99086 1.49897 0.744032 -0.506494 -2.834 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.2490873349314752e-19 1.790640656704704e-19 2.2249586950711685e-19 2.5900306598866564e-19 2.8938994777875844e-19 3.1467870356146563e-19 3.36745482159744e-19 3.5623596075177606e-19 3.7389354928961284e-19 3.91275563448672e-19 4.080086960763072e-19 4.237821249080832e-19 4.384388366351617e-19 4.519099376628481e-19 4.641713953418305e-19 4.7522320967210885e-19 4.850846067731329e-19 4.936995104631745e-19 5.00568041636544e-19 5.057815243606272e-19 5.09524208946816e-19 5.119354847611201e-19 5.132717000628673e-19 5.13713900810208e-19 5.134944026131584e-19 5.127638100740736e-19 5.11390744710048e-19 5.092085801525184e-19 5.060010225576769e-19 5.014844866636416e-19 4.952824609645248e-19 4.868870554715329e-19 4.755949146481345e-19 4.604158933426752e-19 4.399144413029184e-19 4.1193883532712966e-19 3.732046133426688e-19 3.189709347285888e-19 2.401614689280576e-19 1.1920706755270656e-19 -8.114928453754752e-20 -4.5405685433472e-19 ] } }