{ "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" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3656684 -4.0273079 -0.2256106 ] [ -0.0222872 -0.1359914 -1.1097023 ] [ 8.010702 -12.91496 -1.7234285 ] [ -6.3558506 10.2690362 -6.4526011 ] [ 1.7331042 6.8092231 9.5113425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.392395268272166e-09 -6.452458615303608e-09 -3.614680317027204e-10 ] [ -3.57080310772848e-11 -2.178822435049476e-10 -1.777939095756058e-09 ] [ 1.283455956633707e-08 -2.069204714104464e-08 -2.761236873069669e-09 ] [ -1.018319532051488e-08 1.645280985334015e-08 -1.03382067109427e-08 ] [ 2.776739053527263e-09 1.090957814651305e-08 1.523885071147114e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8569617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.781710547972918e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.053545 0.7475249 1.0221375 ] [ -0.7053804 -0.4848677 1.831606 ] [ 3.3238261 0.6212686 1.7256421 ] [ 1.2109196 3.1210376 0.9402463 ] [ 3.4811963 2.9947797 1.6437569 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.053545e-10 7.475249e-11 1.0221375e-10 ] [ -7.053804e-11 -4.848677e-11 1.831606e-10 ] [ 3.3238261e-10 6.212685999999999e-11 1.7256421e-10 ] [ 1.2109196e-10 3.1210376e-10 9.402463e-11 ] [ 3.4811963e-10 2.9947797e-10 1.6437569e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -1.1e-05 4.1e-06 ] [ 1.05e-05 1.17e-05 -6.2e-06 ] [ -5.9e-06 3.2e-06 -0.0 ] [ -3.3e-06 -5.3e-06 3.9e-06 ] [ 4.2e-06 1.5e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.811971486999999e-15 -1.7623942974e-14 6.568924199399999e-15 ] [ 1.6822854657e-14 1.87454666178e-14 -9.9334951308e-15 ] [ -9.452842140600001e-15 5.1269652288e-15 0.0 ] [ -5.2871828922e-15 -8.4915361602e-15 6.248488872599999e-15 ] [ 6.729141862799999e-15 2.403264951e-15 -2.8839179412e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.303887 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.811082362477636e-18 } }