{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9660968 -4.0745435 -1.3144697 ] [ -0.5779076 -7.9503919 1.7696671 ] [ -1.3138174 -0.5289806 0.579328 ] [ 0.4898635 1.8184398 -0.9211236 ] [ 5.1526902 3.7867621 0.3139369 ] [ -3.5714788 3.8763992 -8.522776 ] [ 2.7867469 3.0723149 8.0954373 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.75221098714217e-09 -6.528138389916577e-09 -2.10601263944099e-09 ] [ -9.259100533310184e-10 -1.273793213332286e-08 2.835319277578541e-09 ] [ -2.104967539622631e-09 -8.475203571593004e-10 9.281857850219518e-10 ] [ 7.848478535494589e-10 2.913461757895633e-09 -1.475802708945962e-09 ] [ 8.255519840680786e-09 6.06706175513677e-09 5.029823657303946e-10 ] [ -5.722139882186358e-09 6.210676222296292e-09 -1.365499256401598e-08 ] [ 4.464860768051934e-09 4.922391145070047e-09 1.297032048407205e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.645655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.827145613262527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9863859 2.3301779 2.1784683 ] [ 4.3991105 1.5612263 1.8840016 ] [ 5.5774758 2.1441285 4.0682445 ] [ 3.2074495 1.3177326 4.1245114 ] [ 5.8211718 3.6673097 2.0874216 ] [ 3.6017564 3.7822954 0.9194754 ] [ 3.678586 3.735432 3.4672452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9863859e-10 2.3301779e-10 2.1784683e-10 ] [ 4.3991105e-10 1.5612263e-10 1.8840016e-10 ] [ 5.5774758e-10 2.1441285e-10 4.0682445e-10 ] [ 3.2074495e-10 1.3177326e-10 4.1245114e-10 ] [ 5.8211718e-10 3.6673097e-10 2.0874216e-10 ] [ 3.6017564e-10 3.7822954e-10 9.194754e-11 ] [ 3.678586e-10 3.735432e-10 3.4672452e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -3.3e-06 -8.9e-06 ] [ -5.2e-06 -4.7e-06 4e-07 ] [ 9.3e-06 -1.7e-06 -2.9e-06 ] [ -7.8e-06 1.7e-06 5.7e-06 ] [ 1.54e-05 8.2e-06 -1.7e-06 ] [ -5.7e-06 -8e-07 -4.4e-06 ] [ -4.6e-06 6e-07 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.2430472876e-15 -5.2871828922e-15 -1.42593720426e-14 ] [ -8.331318496799998e-15 -7.530230179799999e-15 6.408706536e-16 ] [ 1.49002426962e-14 -2.7237002778e-15 -4.6463122386e-15 ] [ -1.24969777452e-14 2.7237002778e-15 9.1324068138e-15 ] [ 2.46735201636e-14 1.31378483988e-14 -2.7237002778e-15 ] [ -9.1324068138e-15 -1.2817413072e-15 -7.0495771896e-15 ] [ -7.370012516399999e-15 9.613059803999998e-16 1.90659019446e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.11232 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.542784242753088e-18 } }