{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6680852 0.9296356 -0.1823307 ] [ -7.1370697 -2.0922955 -1.738312 ] [ -5.1067138 24.6026315 -10.6271299 ] [ 11.5525254 -23.2891681 -6.087312 ] [ 0.023173 -0.1508034 18.6350846 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.070390488142492e-09 1.48944042418338e-09 -2.921259847940986e-10 ] [ -1.143484621436007e-08 -3.352226933905047e-09 -2.78508284605609e-09 ] [ -8.181857459476727e-09 3.941776099945764e-08 -1.702653907198464e-08 ] [ 1.850918610707817e-08 -3.731336064770116e-08 -9.752948969915289e-09 ] [ 3.71272388337984e-11 -2.416136818171507e-10 2.985669687275012e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3428077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.75359172397022e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5840481 0.875311 2.70463 ] [ 0.7468978 1.3397905 0.4040265 ] [ 1.6329203 3.3474078 1.2522414 ] [ 2.9563001 0.6338849 0.7980857 ] [ 2.7019427 1.8979525 2.7659465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.840481e-11 8.75311e-11 2.70463e-10 ] [ 7.468977999999999e-11 1.3397905e-10 4.040265e-11 ] [ 1.6329203e-10 3.3474078e-10 1.2522414e-10 ] [ 2.9563001e-10 6.338849e-11 7.980857000000001e-11 ] [ 2.7019427e-10 1.8979525e-10 2.7659465e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.8e-06 2.3e-06 3.3e-06 ] [ -2.4e-06 -6e-06 -5.8e-06 ] [ -2.8e-06 5.1e-06 2.2e-06 ] [ 5.1e-06 -2.7e-06 -6.9e-06 ] [ 9.8e-06 1.4e-06 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.570133088384e-14 3.68500622784e-15 5.28718284864e-15 ] [ -3.84522388992e-15 -9.6130597248e-15 -9.292624400640001e-15 ] [ -4.48609453824e-15 8.17110076608e-15 3.52478856576e-15 ] [ 8.17110076608e-15 -4.32587687616e-15 -1.105501868352e-14 ] [ 1.570133088384e-14 2.24304726912e-15 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }