{ "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" [ 4.20913 3.927103 3.752315 3.625321 3.52552 3.443295 3.373372 3.312546 3.258719 3.210445 3.166686 3.126668 3.089802 3.055627 3.023777 2.993956 2.965921 2.939469 2.914432 2.890666 2.868047 2.846471 2.825846 2.80609 2.786118 2.765537 2.744308 2.722389 2.699735 2.676293 2.652007 2.626815 2.600645 2.573419 2.545049 2.515432 2.484456 2.451989 2.417881 2.381955 2.344009 2.303801 2.261045 2.215394 2.166429 2.113631 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.20913e-10 3.9271029999999997e-10 3.752315e-10 3.6253210000000004e-10 3.5255200000000006e-10 3.4432950000000004e-10 3.373372e-10 3.3125460000000004e-10 3.258719e-10 3.210445e-10 3.166686e-10 3.1266680000000003e-10 3.089802e-10 3.055627e-10 3.023777e-10 2.993956e-10 2.965921e-10 2.939469e-10 2.914432e-10 2.890666e-10 2.868047e-10 2.8464710000000005e-10 2.825846e-10 2.80609e-10 2.7861180000000004e-10 2.7655370000000003e-10 2.7443080000000005e-10 2.7223890000000005e-10 2.6997350000000003e-10 2.6762929999999997e-10 2.652007e-10 2.6268150000000003e-10 2.600645e-10 2.573419e-10 2.545049e-10 2.5154320000000003e-10 2.4844560000000005e-10 2.4519890000000005e-10 2.417881e-10 2.3819550000000003e-10 2.3440089999999996e-10 2.3038010000000002e-10 2.2610450000000004e-10 2.2153939999999998e-10 2.166429e-10 2.113631e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.13064 1.68286 2.10896 2.45898 2.75163 3.00071 3.21658 3.40658 3.57505 3.72391 3.85346 3.96387 4.05602 4.13151 4.19234 4.24055 4.27805 4.30662 4.32786 4.34325 4.35417 4.36152 4.36571 4.36706 4.36562 4.36096 4.35233 4.33866 4.31845 4.28965 4.24965 4.19521 4.12243 4.0266 3.90218 3.74243 3.53937 3.28316 2.96147 2.55824 2.05211 1.4138 0.602227 -0.441623 -1.80117 -3.59116 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.81148498946576e-19 2.69623897029324e-19 3.37892643404064e-19 3.9397202994733196e-19 4.40859729141342e-19 4.80766744741014e-19 5.15352931739172e-19 5.45794287785172e-19 5.7278615753817e-19 5.96636158911894e-19 6.17392357205364e-19 6.350819894213579e-19 6.49846047103668e-19 6.619408785137339e-19 6.716869189783559e-19 6.7941101253087e-19 6.8541917490837e-19 6.899965935517079e-19 6.93399616722324e-19 6.9586536656205e-19 6.976149434463779e-19 6.987925432723679e-19 6.99463855282014e-19 6.99680149127604e-19 6.9944943569230795e-19 6.98702821380864e-19 6.97320142945722e-19 6.951299674870439e-19 6.9189196850973e-19 6.872776998038099e-19 6.8086899326781e-19 6.72146743672314e-19 6.604861021300619e-19 6.4513244344643995e-19 6.25198161766212e-19 5.996033900380619e-19 5.67069591308058e-19 5.26020223768344e-19 4.74479803629198e-19 4.09875235216416e-19 3.2878426923977395e-19 2.2651573251491997e-19 9.648740277639179e-20 -7.075580516369819e-20 -2.8857924878617795e-19 -5.75367264095544e-19 ] } }