{ "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" [ [ 1.711766 1.445938 2.481154 ] [ 1.786648 3.09956 4.150451 ] [ 2.046679 3.825969 2.202277 ] [ 4.127996 2.712807 1.52252 ] [ 4.061478 2.056421 3.562426 ] [ 4.12269 4.38488 2.772359 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.711766e-10 1.445938e-10 2.481154e-10 ] [ 1.786648e-10 3.09956e-10 4.150451000000001e-10 ] [ 2.046679e-10 3.825969e-10 2.202277e-10 ] [ 4.127996e-10 2.712807e-10 1.52252e-10 ] [ 4.061478e-10 2.056421e-10 3.562426e-10 ] [ 4.122690000000001e-10 4.38488e-10 2.772359e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.173294 -1.3219731 0.1106254 ] [ -0.228829 -1.7645221 5.5795068 ] [ -2.1631158 2.4190543 -5.9145068 ] [ 0.9477527 -3.0600127 -7.8521428 ] [ -1.2742516 -1.7183375 4.2505847 ] [ 2.5451496 5.4457911 3.8259328 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.776475953249152e-10 -2.1180343941465e-09 1.772414295466483e-10 ] [ -3.666244739610432e-10 -2.82707605550492e-09 8.939355350554623e-09 ] [ -3.465693562843089e-09 3.875752243905709e-09 -9.47608451852262e-09 ] [ 1.518467218240076e-09 -4.902680807291084e-09 -1.258051961734305e-08 ] [ -2.041576122536993e-09 -2.75308016914392e-09 6.810187431070182e-09 ] [ 4.077779185558471e-09 8.725119182180715e-09 6.129820084911883e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.338765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.297323405414531e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9860115 1.4503801 2.3638367 ] [ 1.61721 2.8890088 4.312741 ] [ 2.0397639 3.9882879 2.1712493 ] [ 3.9195097 2.5238965 1.2751113 ] [ 3.9227481 2.2554786 3.8066969 ] [ 4.3720139 4.418523 2.7615518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9860115e-10 1.4503801e-10 2.3638367e-10 ] [ 1.61721e-10 2.8890088e-10 4.312741e-10 ] [ 2.0397639e-10 3.9882879e-10 2.1712493e-10 ] [ 3.9195097e-10 2.5238965e-10 1.2751113e-10 ] [ 3.922748100000001e-10 2.2554786e-10 3.8066969e-10 ] [ 4.3720139e-10 4.418523e-10 2.7615518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 -1.98e-05 -3.5e-06 ] [ -6.9e-06 -1.44e-05 -1.39e-05 ] [ -1.09e-05 4.19e-05 3.55e-05 ] [ 8.2e-06 -4.52e-05 -2.07e-05 ] [ -1.3e-05 -1e-07 1.27e-05 ] [ 1.64e-05 3.76e-05 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 -3.172309709184e-14 -5.6076181728e-15 ] [ -1.105501868352e-14 -2.307134333952e-14 -2.227025502912e-14 ] [ -1.746372516672e-14 6.713120041152e-14 5.68772700384e-14 ] [ 1.313784829056e-14 -7.241838326016e-14 -3.316505605055999e-14 ] [ -2.08282960704e-14 -1.6021766208e-16 2.034764308416e-14 ] [ 2.627569658112e-14 6.024184094208e-14 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.587451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.817820281166558e-18 } }