{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7417279 1.9035998 2.0417901 ] [ -0.0499473 -0.6462124 -2.4085269 ] [ 0.7564486 -1.1486034 -0.9888505 ] [ -0.7457837 0.6340508 -1.2097556 ] [ -1.1117969 -1.5374341 0.817465 ] [ 2.5271766 -1.8668851 1.323598 ] [ 1.3656306 2.6614844 0.4242798 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.392732378165889e-09 3.049903120047073e-09 3.271308389752523e-09 ] [ -8.00243969913882e-11 -1.035346407881062e-09 -3.858885521540454e-09 ] [ 1.211964271742012e-09 -1.840265529212955e-09 -1.584313165619217e-09 ] [ -1.194877218158066e-09 1.015861376529007e-09 -1.93824215517065e-09 ] [ -1.781295014933635e-09 -2.463240991334819e-09 1.30972332211281e-09 ] [ 4.048983298511565e-09 -2.991079685582753e-09 2.120637788409132e-09 ] [ 2.187981437995401e-09 4.264168117435509e-09 6.797711818381931e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.798894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.614091505184279e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6447336 3.7065357 3.1654468 ] [ 5.3925328 2.7628636 1.7410409 ] [ 3.3503137 1.6386102 2.15552 ] [ 5.5940576 2.1024323 3.9649839 ] [ 3.3381727 1.9357467 4.482401 ] [ 3.3758843 3.6522844 0.9561773 ] [ 4.8644113 4.2135651 3.4558395 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6447336e-10 3.7065357e-10 3.1654468e-10 ] [ 5.3925328e-10 2.762863600000001e-10 1.7410409e-10 ] [ 3.3503137e-10 1.6386102e-10 2.15552e-10 ] [ 5.594057600000001e-10 2.1024323e-10 3.9649839e-10 ] [ 3.3381727e-10 1.9357467e-10 4.482401e-10 ] [ 3.3758843e-10 3.6522844e-10 9.561773000000001e-11 ] [ 4.864411300000001e-10 4.2135651e-10 3.4558395e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.54e-05 -4e-06 2.07e-05 ] [ -5.76e-05 -5.9e-06 1.67e-05 ] [ 7.34e-05 2.91e-05 -8.8e-06 ] [ -2.17e-05 -2.97e-05 2.43e-05 ] [ 9.12e-05 0.0001143 -1.74e-05 ] [ 2.63e-05 4.08e-05 5.1e-06 ] [ -0.000137 -0.0001446 -4.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.06952865036e-14 -6.408706535999999e-15 3.316505632379999e-14 ] [ -9.228537411839999e-14 -9.452842140600001e-15 2.67563497878e-14 ] [ 1.175997649356e-13 4.66233400494e-14 -1.40991543792e-14 ] [ -3.476723295779999e-14 -4.75846460298e-14 3.893289220619999e-14 ] [ 1.461185090208e-13 1.831287892662e-13 -2.78778734316e-14 ] [ 4.21372454742e-14 6.53688066672e-14 8.1711008334e-15 ] [ -2.19498198858e-13 -2.316747412764e-13 -6.4888153677e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.294376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.853694136881038e-18 } }