{ "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" [ [ 2.279778 0.7751999 2.437046 ] [ 2.78251 2.893695 2.394675 ] [ 4.420807 1.465039 1.355448 ] [ 4.595919 1.28038 3.495826 ] [ 3.524345 3.582501 0.1223867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.279778e-10 7.751999000000001e-11 2.437046e-10 ] [ 2.78251e-10 2.893695e-10 2.394675e-10 ] [ 4.420807e-10 1.465039e-10 1.355448e-10 ] [ 4.595919e-10 1.28038e-10 3.495826e-10 ] [ 3.524345e-10 3.582501e-10 1.223867e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1460795 -6.4454585 -0.3186018 ] [ -3.5482647 8.6725609 -1.488235 ] [ 1.9826469 -0.0424366 -4.5681264 ] [ 7.4468367 -2.9805591 7.3462232 ] [ 0.2648606 0.7958934 -0.97126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.847104884478155e-09 -1.032676291903664e-08 -5.104563553047975e-10 ] [ -5.684946746749926e-09 1.389497431644421e-08 -2.384415323256288e-09 ] [ 3.176550510481595e-09 -6.799092838624128e-11 -7.318945318939269e-09 ] [ 1.193114765965542e-08 -4.775382106932689e-09 1.176994706221856e-08 ] [ 4.243534610910605e-10 1.275161798129023e-09 -1.556130064718208e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5417149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.87880605191901e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1041218 0.0383798 1.6215698 ] [ 2.2756692 3.6990094 3.1974012 ] [ 3.5206719 1.9993621 1.961076 ] [ 5.5063785 1.3593033 3.2317562 ] [ 4.1965175 2.9007603 -0.2064216 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1041218e-10 3.83798e-12 1.6215698e-10 ] [ 2.2756692e-10 3.6990094e-10 3.1974012e-10 ] [ 3.5206719e-10 1.9993621e-10 1.961076e-10 ] [ 5.5063785e-10 1.3593033e-10 3.2317562e-10 ] [ 4.1965175e-10 2.9007603e-10 -2.064216e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 -2e-06 -1.3e-06 ] [ 1e-06 -2.1e-06 3e-07 ] [ 5.8e-06 4e-06 6.5e-06 ] [ -6.5e-06 2.2e-06 -4.6e-06 ] [ 8e-07 -2e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 -3.2043532416e-15 -2.08282960704e-15 ] [ 1.6021766208e-15 -3.36457090368e-15 4.8065298624e-16 ] [ 9.292624400640001e-15 6.4087064832e-15 1.04141480352e-14 ] [ -1.04141480352e-14 3.52478856576e-15 -7.370012455680001e-15 ] [ 1.28174129664e-15 -3.2043532416e-15 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.268874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.965690308634098e-18 } }