{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5130662 -0.7650543 -0.5845049 ] [ -0.3620249 -0.4525775 0.5302195 ] [ 0.2310784 -0.042799 -0.6314964 ] [ -0.0663932 -0.1586131 -0.245308 ] [ 3.3858229 -1.6770938 -0.2944269 ] [ -3.4480775 5.4378985 -2.5325536 ] [ 0.7726606 -2.3417608 3.7580704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.220226773351707e-10 -1.225752123201226e-09 -9.364800932385064e-10 ] [ -5.800278357061865e-10 -7.25109095574135e-10 8.495052937911628e-10 ] [ 3.702284131021056e-10 -6.857155775856598e-11 -1.011768776535117e-09 ] [ -1.063736336964888e-10 -2.541262026663054e-10 -3.930267457332719e-10 ] [ 5.424686337242118e-09 -2.687000499386269e-09 -4.717238996010545e-10 ] [ -5.524429202721135e-09 8.712473914763648e-09 -4.057598202272582e-09 ] [ 1.23793875933242e-09 -3.751914436177146e-09 6.021092583807032e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.544176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.131322211798358e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.93858 2.2838521 3.0436763 ] [ 3.1250191 1.5791104 1.0999139 ] [ 4.288103 1.4705553 3.1778827 ] [ 3.9066905 3.7782353 0.7418465 ] [ 5.0904291 3.7277494 2.8103564 ] [ 2.7409179 4.5410459 2.6761682 ] [ 3.5134243 3.2682015 4.5362812 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.93858e-10 2.2838521e-10 3.0436763e-10 ] [ 3.1250191e-10 1.5791104e-10 1.0999139e-10 ] [ 4.288103e-10 1.4705553e-10 3.1778827e-10 ] [ 3.9066905e-10 3.7782353e-10 7.418465e-11 ] [ 5.0904291e-10 3.7277494e-10 2.8103564e-10 ] [ 2.7409179e-10 4.5410459e-10 2.676168200000001e-10 ] [ 3.5134243e-10 3.2682015e-10 4.536281200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 -1.44e-05 2.47e-05 ] [ -1.67e-05 1.02e-05 5.4e-06 ] [ -3e-07 -3.08e-05 -4.2e-06 ] [ 2.51e-05 6.8e-06 -8.6e-06 ] [ -2e-06 1.28e-05 4.5e-06 ] [ -1.46e-05 1.39e-05 -1.35e-05 ] [ -7e-06 1.5e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.46735201636e-14 -2.30713435296e-14 3.95737628598e-14 ] [ -2.67563497878e-14 1.63422016668e-14 8.6517538236e-15 ] [ -4.806529901999999e-16 -4.93470403272e-14 -6.729141862799999e-15 ] [ 4.02146335134e-14 1.08948011112e-14 -1.37787190524e-14 ] [ -3.204353268e-15 2.05078609152e-14 7.209794853e-15 ] [ -2.33917788564e-14 2.22702552126e-14 -2.162938455899999e-14 ] [ -1.1215236438e-14 2.403264951e-15 -1.32980660622e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }