{ "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" [ [ -8.22022670562697e-10 -1.225752113102509e-09 -9.36480085523042e-10 ] [ -5.800278309274579e-10 -7.25109089600112e-10 8.495052867922656e-10 ] [ 3.702284100518708e-10 -6.85715571936192e-11 -1.011768768199365e-09 ] [ -1.063736328200986e-10 -2.541262005726125e-10 -3.930267424952064e-10 ] [ 5.424686292549257e-09 -2.687000477248631e-09 -4.717238957146195e-10 ] [ -5.524429157206512e-09 8.71247384298339e-09 -4.057598168842875e-09 ] [ 1.237938749133301e-09 -3.751914405265904e-09 6.021092534200505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.544176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.131322186000046e-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" [ [ 2.467351996032e-14 -2.307134333952e-14 3.957376253376001e-14 ] [ -2.675634956736e-14 1.634220153216e-14 8.65175375232e-15 ] [ -4.8065298624e-16 -4.934703992064001e-14 -6.72914180736e-15 ] [ 4.021463318208e-14 1.089480102144e-14 -1.377871893888e-14 ] [ -3.2043532416e-15 2.050786074624e-14 7.2097947936e-15 ] [ -2.339177866368e-14 2.227025502912e-14 -2.16293843808e-14 ] [ -1.12152363456e-14 2.4032649312e-15 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }