{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.611679 2.016684 2.717461 ] [ 4.323341 0.727724 2.330974 ] [ 4.46399 3.048062 1.959515 ] [ 3.51112 1.5374 4.631239 ] [ 3.533059 3.74018 3.907793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.611679e-10 2.016684e-10 2.717461e-10 ] [ 4.323341e-10 7.27724e-11 2.330974e-10 ] [ 4.46399e-10 3.048062e-10 1.959515e-10 ] [ 3.51112e-10 1.5374e-10 4.631239e-10 ] [ 3.533059e-10 3.74018e-10 3.907793e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.28978 -1.2752895 -2.6817366 ] [ 2.5625487 -3.4257053 -1.1071279 ] [ 3.3628883 2.5120982 -3.0819977 ] [ 0.756433 -2.0159238 4.3232573 ] [ 0.6079099 4.2048204 2.5476048 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.167951508677543e-08 -2.043239021651722e-09 -4.296615683663681e-09 ] [ 4.105655616801433e-09 -5.488584941410651e-09 -1.7738144376154e-09 ] [ 5.387941012621857e-09 4.024825005193763e-09 -4.937904660299372e-09 ] [ 1.211939267801607e-09 -3.229865981674295e-09 6.926621771762932e-09 ] [ 9.73979029332866e-10 6.736864939542904e-09 4.08171284959786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.0324606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.665067339217142e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0483293 2.0420257 2.4875106 ] [ 4.0822915 0.8603845 2.445444 ] [ 4.9131799 3.0413434 2.1486905 ] [ 4.1043939 1.5586544 4.6919863 ] [ 3.2949944 3.567642 3.7733506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0483293e-10 2.0420257e-10 2.4875106e-10 ] [ 4.0822915e-10 8.603845e-11 2.445444e-10 ] [ 4.913179900000001e-10 3.0413434e-10 2.1486905e-10 ] [ 4.1043939e-10 1.5586544e-10 4.6919863e-10 ] [ 3.2949944e-10 3.567642e-10 3.7733506e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.06e-05 1.49e-05 8.9e-06 ] [ -1.33e-05 -1.12e-05 -1.27e-05 ] [ -4.6e-06 5.6e-06 1.25e-05 ] [ 2.7e-06 2.46e-05 2.5e-06 ] [ -5.4e-06 -3.4e-05 -1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.300483838848e-14 2.387243164992e-14 1.425937192512e-14 ] [ -2.130894905664e-14 -1.794437815296e-14 -2.034764308416e-14 ] [ -7.370012455680001e-15 8.972189076479999e-15 2.002720776e-14 ] [ 4.32587687616e-15 3.941354487168e-14 4.005441552e-15 ] [ -8.65175375232e-15 -5.44740051072e-14 -1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }