{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0424551 -1.2293396 -2.2477237 ] [ -35.341326 -12.9899651 26.0617615 ] [ -2.8587486 1.2617551 1.7660073 ] [ 0.9198696 11.6266098 -19.2365672 ] [ 32.5863992 -6.9954245 -9.8261332 ] [ 2.6513506 8.3263644 3.4826553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.272373837214134e-09 -1.969619182370906e-09 -3.601250391828025e-09 ] [ -5.662304673177668e-08 -2.081221855969547e-08 4.175554531618078e-08 ] [ -4.580220209400212e-09 2.021554539050333e-09 2.829455631533428e-09 ] [ 1.473793579446926e-09 1.862788255419541e-08 -3.08203784862108e-08 ] [ 5.220916738443629e-08 -1.120790567881113e-08 -1.574320101561165e-08 ] [ 4.247931979861879e-09 1.334030648784943e-08 5.57982894593626e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.33776648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.411615620044282e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.0662798 1.3488711 0.4557575 ] [ 1.0594588 -0.107286 2.3627674 ] [ 0.3086604 2.3449001 2.7706456 ] [ 2.4961919 1.5750387 -0.154249 ] [ 2.8780079 0.3475184 1.9766518 ] [ 2.7837551 2.7569554 2.5924054 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.62798e-12 1.3488711e-10 4.557575e-11 ] [ 1.0594588e-10 -1.07286e-11 2.3627674e-10 ] [ 3.086604e-11 2.3449001e-10 2.7706456e-10 ] [ 2.4961919e-10 1.5750387e-10 -1.54249e-11 ] [ 2.8780079e-10 3.475184e-11 1.9766518e-10 ] [ 2.7837551e-10 2.7569554e-10 2.5924054e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -3.19e-05 4.73e-05 ] [ -0.0002305 -2.81e-05 3.01e-05 ] [ -5.94e-05 2.4e-06 -6.93e-05 ] [ -3.39e-05 8.08e-05 3.86e-05 ] [ 0.0002572 3.5e-06 -8.7e-06 ] [ 6.75e-05 -2.67e-05 -3.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4419589706e-15 -5.11094346246e-14 7.578295478819998e-14 ] [ -3.693017141369999e-13 -4.50211634154e-14 4.82255166834e-14 ] [ -9.51692920596e-14 3.845223921599999e-15 -1.110308407362e-13 ] [ -5.431378789259999e-14 1.294558720272e-13 6.18440180724e-14 ] [ 4.120798302648e-13 5.607618218999999e-15 -1.39389367158e-14 ] [ 1.08146922795e-13 -4.277811612779999e-14 -6.10429297554e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.225572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279187906368465e-18 } }