{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0456455 0.2421984 -1.9749349 ] [ 0.5115775 -0.0848737 1.9508566 ] [ -1.317233 0.6489174 -1.2166118 ] [ -0.1456613 -0.0609733 -0.5529944 ] [ 0.1438719 -0.1865856 -0.5779808 ] [ 0.0875742 0.119345 1.1849252 ] [ 0.7655163 -0.6780283 1.18674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.313215294472639e-11 3.880446140751667e-10 -3.164194524381986e-09 ] [ 8.19637510227312e-10 -1.359826578607929e-10 3.125616835053377e-09 ] [ -2.110439916746247e-09 1.039680287110322e-09 -1.949226982549405e-09 ] [ -2.33375129415335e-10 -9.768999575302465e-11 -8.859946991133236e-10 ] [ 2.305081945700755e-10 -2.989430860979404e-10 -9.260273250312806e-10 ] [ 1.403093358252634e-10 1.91211768809376e-10 1.898459452836764e-09 ] [ 1.226492318701319e-09 -1.086321090500769e-09 1.901367082968192e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.794901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.812363407645054e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6107878 1.6364656 1.7296426 ] [ 1.8660748 1.9865609 4.0689293 ] [ 2.5140902 3.7600944 2.307823 ] [ 3.7633286 0.7166327 1.5953672 ] [ 4.7344568 2.8112734 2.1694002 ] [ 4.0864612 1.0378011 3.930438 ] [ 3.8108857 3.4169883 4.3322716 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6107878e-10 1.6364656e-10 1.7296426e-10 ] [ 1.8660748e-10 1.9865609e-10 4.0689293e-10 ] [ 2.5140902e-10 3.7600944e-10 2.307823e-10 ] [ 3.7633286e-10 7.166327e-11 1.5953672e-10 ] [ 4.7344568e-10 2.8112734e-10 2.1694002e-10 ] [ 4.0864612e-10 1.0378011e-10 3.930438e-10 ] [ 3.8108857e-10 3.4169883e-10 4.3322716e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.18e-05 -1.6e-06 -7.47e-05 ] [ -3.87e-05 -1.4e-06 5.81e-05 ] [ -1.13e-05 -6.4e-06 1e-07 ] [ 5.88e-05 4.15e-05 5.92e-05 ] [ 9e-07 -2.23e-05 -1.44e-05 ] [ -5e-07 4.14e-05 -1.55e-05 ] [ 5.25e-05 -5.12e-05 -1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.901451516544e-14 -2.56348259328e-15 -1.1968259357376e-13 ] [ -6.200423522496e-14 -2.24304726912e-15 9.308646166848001e-14 ] [ -1.810459581504e-14 -1.025393037312e-14 1.6021766208e-16 ] [ 9.420798530304e-14 6.64903297632e-14 9.484885595136001e-14 ] [ 1.44195895872e-15 -3.572853864384e-14 -2.307134333952e-14 ] [ -8.010883104e-16 6.633011210111999e-14 -2.48337376224e-14 ] [ 8.4114272592e-14 -8.203144298496001e-14 -2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }