{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9502461 -0.2775397 -0.220462 ] [ 0.6694101 0.3931417 -0.4288282 ] [ -0.187174 0.2823818 -0.1793389 ] [ 1.2777311 -0.6883257 -1.7043107 ] [ 0.190279 0.290342 2.5329398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.124638706226379e-09 -4.446676186838458e-10 -3.532190621748096e-10 ] [ 1.07251321194739e-09 6.298824404015672e-10 -6.870585163797466e-10 ] [ -2.998858068216192e-10 4.524255180994215e-10 -2.873325927799891e-10 ] [ 2.047150896089067e-09 -1.102819344035795e-09 -2.730606758119282e-09 ] [ 3.048605652292032e-10 4.651791644363136e-10 4.058216929453828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.656169775408902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.46000635663573e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8285385 2.3390554 1.1984143 ] [ 2.4638221 1.8083652 3.3851414 ] [ 2.7280584 4.1179222 2.4204999 ] [ 4.1369882 2.2222679 1.551127 ] [ 4.3907087 3.0933114 3.7060973 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8285385e-10 2.3390554e-10 1.1984143e-10 ] [ 2.4638221e-10 1.8083652e-10 3.3851414e-10 ] [ 2.7280584e-10 4.1179222e-10 2.4204999e-10 ] [ 4.1369882e-10 2.2222679e-10 1.551127e-10 ] [ 4.390708700000001e-10 3.0933114e-10 3.7060973e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.08e-05 7e-07 -9.7e-06 ] [ -1.3e-06 1.3e-06 -1.9e-06 ] [ -3.3e-06 -3.6e-06 -1e-07 ] [ 1.24e-05 -5.9e-06 -6.6e-06 ] [ 1.3e-05 7.6e-06 1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.332527371264e-14 1.12152363456e-15 -1.554111322176e-14 ] [ -2.08282960704e-15 2.08282960704e-15 -3.04413557952e-15 ] [ -5.28718284864e-15 -5.76783583488e-15 -1.6021766208e-16 ] [ 1.986699009792e-14 -9.45284206272e-15 -1.057436569728e-14 ] [ 2.08282960704e-14 1.217654231808e-14 2.931983216064e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }