{ "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" [ "Si" "Si" ] } "a" { "source-value" [ 4.8081 4.48594 4.286277 4.141212 4.027208 3.933282 3.85341 3.783927 3.72244 3.667297 3.617311 3.571598 3.529485 3.490447 3.454065 3.420001 3.387976 3.35776 3.32916 3.302011 3.276174 3.251528 3.227967 3.2054 3.190037 3.173868 3.156804 3.13874 3.119551 3.099088 3.077169 3.053572 3.028019 3.000154 2.969518 2.935498 2.897253 2.853583 2.80269 2.741701 2.665596 2.56432 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.8081e-10 4.4859400000000003e-10 4.2862770000000004e-10 4.1412120000000003e-10 4.0272080000000003e-10 3.933282e-10 3.85341e-10 3.783927e-10 3.7224400000000003e-10 3.667297e-10 3.617311e-10 3.5715979999999997e-10 3.5294850000000005e-10 3.490447e-10 3.454065e-10 3.4200010000000004e-10 3.387976e-10 3.35776e-10 3.32916e-10 3.302011e-10 3.276174e-10 3.251528e-10 3.227967e-10 3.2054e-10 3.190037e-10 3.1738680000000004e-10 3.156804e-10 3.13874e-10 3.119551e-10 3.099088e-10 3.077169e-10 3.053572e-10 3.028019e-10 3.0001540000000005e-10 2.969518e-10 2.935498e-10 2.8972530000000004e-10 2.853583e-10 2.8026900000000005e-10 2.7417010000000003e-10 2.665596e-10 2.56432e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.49735 2.02267 2.39876 2.69154 2.92953 3.12812 3.2967 3.44148 3.56678 3.67578 3.77084 3.85382 3.92617 3.98906 4.04343 4.09009 4.12969 4.16279 4.18988 4.21135 4.22757 4.23883 4.24542 4.24757 4.24653 4.2431 4.23674 4.22675 4.21222 4.19198 4.16445 4.12752 4.07826 4.01251 3.92422 3.80427 3.63831 3.40255 3.05473 2.51273 1.59605 -0.154426 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.3990191829199e-19 3.24067461229278e-19 3.8432372225738394e-19 4.3123224974763593e-19 4.69362451460202e-19 5.011800772348079e-19 5.2818957093078e-19 5.51385884237832e-19 5.71461157461852e-19 5.88924882772452e-19 6.04155173855256e-19 6.174500355641879e-19 6.29041783511178e-19 6.39117872362404e-19 6.478289067214619e-19 6.55304662895706e-19 6.61649282366346e-19 6.66952487024886e-19 6.712927835263919e-19 6.7473265675959e-19 6.773313872599379e-19 6.79135438149822e-19 6.801912725516279e-19 6.805357405279379e-19 6.803691141580019e-19 6.7981956757254e-19 6.78800583233316e-19 6.772000087759499e-19 6.74872046126748e-19 6.716292406195319e-19 6.6721844834613e-19 6.613016100367679e-19 6.534092879376839e-19 6.428749765691339e-19 6.28729359067548e-19 6.095112503427179e-19 5.82921526924854e-19 5.4514861060167e-19 4.89421702917882e-19 4.0258372935508194e-19 2.5571540166956997e-19 -2.47417728882084e-20 ] } }