{ "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" [ "Ni" "Ni" ] } "a" { "source-value" [ 4.17393 3.894261 3.720934 3.595002 3.496035 3.414497 3.34516 3.284842 3.231465 3.183595 3.140201 3.100518 3.06396 3.030071 2.998487 2.968916 2.941115 2.914884 2.890056 2.866489 2.84406 2.822664 2.80221 2.78262 2.769283 2.755247 2.740434 2.724752 2.708094 2.69033 2.671303 2.650819 2.628636 2.604446 2.577851 2.548319 2.515119 2.477209 2.433028 2.380084 2.314017 2.2261 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1739300000000007e-10 3.894261e-10 3.7209340000000005e-10 3.595002e-10 3.496035e-10 3.414497e-10 3.34516e-10 3.284842e-10 3.2314650000000004e-10 3.183595e-10 3.140201e-10 3.1005180000000004e-10 3.06396e-10 3.0300710000000003e-10 2.998487e-10 2.9689160000000004e-10 2.941115e-10 2.914884e-10 2.890056e-10 2.866489e-10 2.8440599999999997e-10 2.8226640000000004e-10 2.80221e-10 2.78262e-10 2.769283e-10 2.755247e-10 2.740434e-10 2.724752e-10 2.7080940000000003e-10 2.69033e-10 2.6713030000000003e-10 2.650819e-10 2.628636e-10 2.604446e-10 2.577851e-10 2.5483189999999997e-10 2.515119e-10 2.4772090000000003e-10 2.4330280000000004e-10 2.380084e-10 2.3140170000000002e-10 2.2261000000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.882177 1.34932 1.75057 2.05271 2.31221 2.57431 2.85148 3.11254 3.33928 3.53081 3.69037 3.82285 3.93336 4.02608 4.10405 4.1694 4.22371 4.26833 4.30451 4.33329 4.35541 4.37125 4.38088 4.38414 4.38249 4.37693 4.36638 4.34949 4.32464 4.28999 4.24358 4.18321 4.10641 4.01023 3.88967 3.7335 3.51625 3.18528 2.64338 1.72795 0.16097 -2.78716 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4134033648074818e-19 2.1618489579778563e-19 2.804722327073856e-19 3.288803971282368e-19 3.704568804379968e-19 4.1244992966916485e-19 4.568574590678785e-19 4.986838819304832e-19 5.350116346305025e-19 5.656981234486848e-19 5.912624536101696e-19 6.12488089482528e-19 6.301937433189888e-19 6.450491249470465e-19 6.57541296059424e-19 6.680115202763521e-19 6.767129415039167e-19 6.838618535859264e-19 6.896585285999808e-19 6.942695929146432e-19 6.978136075998529e-19 7.003514553672e-19 7.018943514530305e-19 7.024166610314113e-19 7.021523018889792e-19 7.012614916878144e-19 6.995711953528705e-19 6.968651190403393e-19 6.928837101376512e-19 6.873321681465793e-19 6.798964664494464e-19 6.7022412618967685e-19 6.5791940974193285e-19 6.425096750030784e-19 6.2319383366271365e-19 5.9817264137568e-19 5.633653542888e-19 5.103381146701825e-19 4.235161635890304e-19 2.76848109191136e-19 2.57902370650176e-20 -4.465522590428928e-19 ] } }