{ "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" [ "Cu" "Cu" ] } "a" { "source-value" [ 4.30233 4.014058 3.835399 3.705593 3.603581 3.519535 3.448065 3.385891 3.330872 3.28153 3.236801 3.195897 3.158215 3.123283 3.090728 3.060246 3.03159 3.004553 2.978961 2.954669 2.93155 2.909496 2.888413 2.86822 2.854473 2.840005 2.824736 2.808572 2.791402 2.773091 2.753479 2.732364 2.709499 2.684565 2.657152 2.626711 2.59249 2.553413 2.507874 2.453301 2.385202 2.29458 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.3023300000000005e-10 4.0140580000000007e-10 3.8353989999999997e-10 3.705593e-10 3.6035810000000005e-10 3.519535e-10 3.4480650000000004e-10 3.385891e-10 3.3308719999999997e-10 3.28153e-10 3.236801e-10 3.195897e-10 3.158215e-10 3.1232829999999997e-10 3.090728e-10 3.060246e-10 3.03159e-10 3.004553e-10 2.978961e-10 2.954669e-10 2.93155e-10 2.909496e-10 2.888413e-10 2.86822e-10 2.854473e-10 2.840005e-10 2.824736e-10 2.808572e-10 2.7914020000000004e-10 2.773091e-10 2.753479e-10 2.732364e-10 2.709499e-10 2.6845650000000004e-10 2.657152e-10 2.6267109999999997e-10 2.5924900000000005e-10 2.553413e-10 2.507874e-10 2.4533010000000005e-10 2.3852020000000003e-10 2.2945799999999998e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.91032 1.3983 1.75457 2.02788 2.24587 2.42844 2.58515 2.721 2.83969 2.94401 3.03576 3.11591 3.18536 3.24525 3.29684 3.34126 3.37928 3.4114 3.4379 3.45904 3.47504 3.48615 3.49262 3.49472 3.4937 3.49035 3.4841 3.47423 3.45983 3.43967 3.41216 3.37511 3.32553 3.25911 3.16955 3.0473 2.87732 2.63474 2.27556 1.71335 0.752883 -1.11374 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4584934214466561e-19 2.24032356886464e-19 2.811131033557056e-19 3.2490219257879045e-19 3.598280407356096e-19 3.8907897930155524e-19 4.1418668912611203e-19 4.3595225851968e-19 4.549684928319553e-19 4.716823993401409e-19 4.863823698359808e-19 4.992238154516928e-19 5.103509320831489e-19 5.1994636786512e-19 5.282119970518272e-19 5.353288656014209e-19 5.4142034111370245e-19 5.465665324197121e-19 5.50812300464832e-19 5.541993018412032e-19 5.567627844344832e-19 5.58542802660192e-19 5.595794109338497e-19 5.599158680242177e-19 5.59752446008896e-19 5.59215716840928e-19 5.582143564529281e-19 5.566330081281985e-19 5.543258737942464e-19 5.510958857267136e-19 5.466882978428928e-19 5.407522334628288e-19 5.328086417769025e-19 5.221669846615488e-19 5.078178908456641e-19 4.88231281656384e-19 4.609974834560256e-19 4.221318829886592e-19 3.645849031227648e-19 2.7450893132476802e-19 1.2062515407977663e-19 -1.784408189649792e-19 ] } }