{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.189031 -8.4661139 -11.9613415 ] [ 0.2283902 -7.1404749 7.0439779 ] [ -7.7415794 7.9593994 -3.9077296 ] [ 5.1826665 11.1335594 4.2432631 ] [ 0.1414917 -3.4863699 4.5818302 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.507214319301653e-09 -1.356420987136261e-08 -1.916418186259451e-08 ] [ 3.659214418745867e-10 -1.144030204044349e-08 1.128569680179239e-08 ] [ -1.240337762493574e-08 1.275236373935362e-08 -6.260873057110166e-09 ] [ 8.30354716811456e-09 1.783792872393106e-08 6.798456990734405e-09 ] [ 2.266946956449378e-10 -5.585780391260916e-09 7.340901287395546e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.85209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.059131829606506e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3514396 1.864193 1.2003676 ] [ 1.0559086 1.7546979 3.3926636 ] [ 0.4038065 3.4542311 1.6105127 ] [ 2.5765935 3.7421723 2.9088913 ] [ 3.5854896 1.4531507 3.3907758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3514396e-10 1.864193e-10 1.2003676e-10 ] [ 1.0559086e-10 1.7546979e-10 3.3926636e-10 ] [ 4.038065e-11 3.4542311e-10 1.6105127e-10 ] [ 2.5765935e-10 3.7421723e-10 2.9088913e-10 ] [ 3.5854896e-10 1.4531507e-10 3.3907758e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.32e-05 -3.42e-05 -6.8e-06 ] [ 3.25e-05 1.54e-05 1.33e-05 ] [ -5.79e-05 1.45e-05 -2.89e-05 ] [ 1.73e-05 9.8e-06 4.41e-05 ] [ -2.51e-05 -5.5e-06 -2.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.31922642488e-14 -5.479444088279999e-14 -1.08948011112e-14 ] [ 5.207074060499999e-14 2.46735201636e-14 2.13089492322e-14 ] [ -9.276602710859999e-14 2.3231561193e-14 -4.63029047226e-14 ] [ 2.77176557682e-14 1.57013310132e-14 7.06559895594e-14 ] [ -4.02146335134e-14 -8.811971486999999e-15 -3.492745062119999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.756113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.844842935926364e-18 } }