{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.364141 -1.4097131 -2.7696706 ] [ 1.4187165 -3.8114437 0.7431881 ] [ -1.6486772 3.3186692 -2.6752473 ] [ -0.1275775 -1.9868207 1.886798 ] [ 1.0911447 0.8011627 0.2081907 ] [ 1.7897992 1.7202884 -2.9158468 ] [ 0.8407353 1.3678571 5.5225879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.389948059274733e-09 -2.258609370855492e-09 -4.437501482637109e-09 ] [ 2.273034407843203e-09 -6.106605987635449e-09 1.190718598676773e-09 ] [ -2.641472065086006e-09 5.31709420440904e-09 -4.286218678918324e-09 ] [ -2.04401687840112e-10 -3.18323767526149e-09 3.022983643772198e-09 ] [ 1.74820652824983e-09 1.283604147397004e-09 3.335582722079866e-10 ] [ 2.867574434166543e-09 2.756205855513439e-09 -4.671701572794494e-09 ] [ 1.347006441941274e-09 2.191548666215288e-09 8.848161219692968e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.663893 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.990285301771278e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7734101 3.8475322 2.1221803 ] [ 4.6017722 1.227453 2.0034341 ] [ 3.3888406 2.7850208 0.7432547 ] [ 4.2870214 1.8853252 4.2923994 ] [ 5.8806545 3.0298358 2.9219331 ] [ 4.1793319 4.5355435 2.2552319 ] [ 2.9129123 3.7798985 4.2047058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7734101e-10 3.8475322e-10 2.1221803e-10 ] [ 4.6017722e-10 1.227453e-10 2.0034341e-10 ] [ 3.3888406e-10 2.7850208e-10 7.432547000000001e-11 ] [ 4.2870214e-10 1.8853252e-10 4.2923994e-10 ] [ 5.8806545e-10 3.0298358e-10 2.9219331e-10 ] [ 4.1793319e-10 4.5355435e-10 2.2552319e-10 ] [ 2.9129123e-10 3.7798985e-10 4.2047058e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.71e-05 -1.28e-05 -2.67e-05 ] [ -1.67e-05 2.04e-05 3.54e-05 ] [ -1.55e-05 3.53e-05 -1.9e-05 ] [ -7.4e-06 1.2e-05 -6.3e-06 ] [ 4.81e-05 1.4e-06 -2.18e-05 ] [ -2.02e-05 -5.05e-05 2.7e-06 ] [ -1.53e-05 -5.9e-06 3.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.341898642368e-14 -2.050786074624e-14 -4.277811577536e-14 ] [ -2.675634956736e-14 3.268440306432e-14 5.671705237632e-14 ] [ -2.48337376224e-14 5.655683471424e-14 -3.04413557952e-14 ] [ -1.185610699392e-14 1.92261194496e-14 -1.009371271104e-14 ] [ 7.706469546047999e-14 2.24304726912e-15 -3.492745033344e-14 ] [ -3.236396774016e-14 -8.090991935040001e-14 4.32587687616e-15 ] [ -2.451330229824e-14 -9.45284206272e-15 5.719770536256001e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.244274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.56392557494693e-18 } }