{ "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" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9897728 -5.7503366 -9.3857612 ] [ -6.8700682 -11.7131861 4.1802937 ] [ -10.0438524 9.8347838 4.871752 ] [ 4.1979433 4.9022583 -25.2003405 ] [ 10.11904 -18.4086656 18.600747 ] [ 6.5867102 21.1351462 6.933309 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.392320702463754e-09 -9.213054862250561e-09 -1.503764716305175e-08 ] [ -1.100706265334154e-08 -1.876659292449953e-08 6.697568834217529e-09 ] [ -1.609202549804597e-08 1.575706067498258e-08 7.805407156735642e-09 ] [ 6.725846610704001e-09 7.854283637382752e-09 -4.037539638529938e-08 ] [ 1.621248931294003e-08 -2.94939336444452e-08 2.980168197281574e-08 ] [ 1.055307309042489e-08 3.386223711882996e-08 1.110838558458223e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.57256331 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.17347549209863e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.5391732 0.53986 0.3584502 ] [ 0.5767659 -0.3816926 2.5776801 ] [ 0.0497423 1.9399783 2.2494229 ] [ 2.8144629 1.0827933 0.5453533 ] [ 2.8520623 0.1612149 2.7645722 ] [ 2.3250374 2.4828872 2.4363449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.391732e-11 5.3986e-11 3.584502e-11 ] [ 5.767659000000001e-11 -3.816926e-11 2.5776801e-10 ] [ 4.974230000000001e-12 1.9399783e-10 2.2494229e-10 ] [ 2.8144629e-10 1.0827933e-10 5.453533000000001e-11 ] [ 2.8520623e-10 1.612149e-11 2.7645722e-10 ] [ 2.3250374e-10 2.4828872e-10 2.4363449e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 -3.1e-06 -2.04e-05 ] [ -8.1e-06 -6.3e-06 4.4e-06 ] [ 5.7e-06 2.2e-06 1.06e-05 ] [ 6.3e-06 -6.2e-06 -1.86e-05 ] [ 1e-05 -1.31e-05 1.5e-05 ] [ -7e-06 2.65e-05 9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.089480102144e-14 -4.96674752448e-15 -3.268440306432e-14 ] [ -1.297763062848e-14 -1.009371271104e-14 7.04957713152e-15 ] [ 9.13240673856e-15 3.52478856576e-15 1.698307218048e-14 ] [ 1.009371271104e-14 -9.93349504896e-15 -2.980048514688e-14 ] [ 1.6021766208e-14 -2.098851373248e-14 2.4032649312e-14 ] [ -1.12152363456e-14 4.24576804512e-14 1.44195895872e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }