{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6033618 0.1254164 -0.8887745 ] [ -0.3516509 0.5129899 -0.3139806 ] [ 0.6026195 -0.9652317 0.0691835 ] [ 0.0532022 -0.0646389 -0.5786654 ] [ 0.1832676 -0.8474628 0.1297764 ] [ -0.9286476 -0.0447404 0.0766204 ] [ 1.044571 1.2836676 1.5058401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.666921698438054e-10 2.009392239449011e-10 -1.42397372506321e-09 ] [ -5.634068506632788e-10 8.219004244865299e-10 -5.030523767047564e-10 ] [ 9.655028741381857e-10 -1.546471663395039e-09 1.108441862451168e-10 ] [ 8.523932101512576e-11 -1.035629343742291e-10 -9.271241751458803e-10 ] [ 2.936270640701261e-10 -1.357785085157706e-09 2.079247140115891e-10 ] [ -1.48785747368203e-09 -7.168202288524031e-11 1.227594135563443e-10 ] [ 1.673587234965677e-09 2.056662217598446e-09 2.412621802883134e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.107824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.221628550796114e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9083283 2.4491858 3.7583434 ] [ 2.1467182 4.6733867 2.9379845 ] [ 2.9214757 2.863471 1.5960158 ] [ 5.0193228 2.1536691 2.4778975 ] [ 4.0322437 1.7500278 4.5845823 ] [ 4.5030095 4.474823 2.6457565 ] [ 3.4898788 4.0605274 4.808084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9083283e-10 2.4491858e-10 3.7583434e-10 ] [ 2.1467182e-10 4.6733867e-10 2.9379845e-10 ] [ 2.9214757e-10 2.863471e-10 1.5960158e-10 ] [ 5.019322800000001e-10 2.1536691e-10 2.4778975e-10 ] [ 4.032243700000001e-10 1.7500278e-10 4.5845823e-10 ] [ 4.5030095e-10 4.474823e-10 2.6457565e-10 ] [ 3.4898788e-10 4.0605274e-10 4.808084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.6e-06 -2.92e-05 -3.9e-06 ] [ 1.79e-05 2.43e-05 5.8e-06 ] [ -2.57e-05 -5.7e-06 -2.73e-05 ] [ 8.4e-06 -1.29e-05 -6.5e-06 ] [ 3.7e-06 2.63e-05 5.2e-06 ] [ 1e-06 -8.9e-06 9.5e-06 ] [ -1.49e-05 6.1e-06 1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.538089555968e-14 -4.678355732736e-14 -6.24848882112e-15 ] [ 2.867896151232001e-14 3.893289188544e-14 9.292624400640001e-15 ] [ -4.117593915456e-14 -9.13240673856e-15 -4.373942174784e-14 ] [ 1.345828361472e-14 -2.066807840832e-14 -1.04141480352e-14 ] [ 5.928053496960001e-15 4.213724512704e-14 8.33131842816e-15 ] [ 1.6021766208e-15 -1.425937192512e-14 1.52206778976e-14 ] [ -2.387243164992e-14 9.77327738688e-15 2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }