{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1734784 -0.5409202 -1.0050111 ] [ 0.2982095 -1.5404941 1.0569007 ] [ -1.642779 2.203595 -0.507775 ] [ -0.5826384 1.9165761 -0.6957771 ] [ 1.7537295 -2.0387568 1.1516625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.779430366937908e-10 -8.666496981584601e-10 -1.610205288064491e-09 ] [ 4.777842890004577e-10 -2.468143631500338e-09 1.693341592047154e-09 ] [ -2.632022106941203e-09 3.530548390711776e-09 -8.135452336267199e-10 ] [ -9.334896228603188e-10 3.070693419404043e-09 -1.114757802908024e-09 ] [ 2.809784404107273e-09 -3.266448480457021e-09 1.84516673255208e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.171169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.469383255720572e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7225745 2.1813422 0.8858419 ] [ 1.254239 2.086847 3.5296609 ] [ 0.3690129 3.9013456 2.0726245 ] [ 2.3837586 5.1188374 2.4730081 ] [ 3.3834715 2.9526338 2.5727096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7225745e-10 2.1813422e-10 8.858419e-11 ] [ 1.254239e-10 2.086847e-10 3.5296609e-10 ] [ 3.690129e-11 3.9013456e-10 2.0726245e-10 ] [ 2.3837586e-10 5.1188374e-10 2.4730081e-10 ] [ 3.3834715e-10 2.9526338e-10 2.5727096e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 4.1e-06 1.39e-05 ] [ 6e-07 1.58e-05 -9.6e-06 ] [ 5.7e-06 -2.43e-05 -5.7e-06 ] [ 9.4e-06 5.1e-06 1.27e-05 ] [ -1.25e-05 -7e-07 -1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 6.568924145279999e-15 2.227025502912e-14 ] [ 9.6130597248e-16 2.531439060864e-14 -1.538089555968e-14 ] [ 9.13240673856e-15 -3.893289188544e-14 -9.13240673856e-15 ] [ 1.506046023552e-14 8.17110076608e-15 2.034764308416e-14 ] [ -2.002720776e-14 -1.12152363456e-15 -1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }