{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.510043 -1.8739918 -0.2470898 ] [ -1.7407904 -2.47095 -0.8862796 ] [ -4.3557002 2.3274458 2.2231366 ] [ 0.1952669 1.3446158 0.7618843 ] [ -0.1635716 0.0924625 -1.1782397 ] [ 4.909797 -2.3569653 1.7520831 ] [ 0.6449553 2.937383 -2.4254949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.171789702026945e-10 -3.00246584953091e-09 -3.958815007981479e-10 ] [ -2.78905368059308e-09 -3.958898321165761e-09 -1.419976454611976e-09 ] [ -6.978601027653885e-09 3.728979246939153e-09 3.561857485364801e-09 ] [ 3.128520619960915e-10 2.154311998718289e-09 1.220673213214573e-09 ] [ -2.620705933468493e-10 1.4814125580072e-10 -1.887748101038406e-09 ] [ 7.866361966273979e-09 -3.776274699696859e-09 2.807146580518788e-09 ] [ 1.03333230312105e-09 4.706206368935367e-09 -3.886071222649633e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.844726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.01925794225819e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5770791 1.3267843 1.8885951 ] [ 2.2926138 0.3681239 3.9876226 ] [ 2.4819819 2.5191307 4.9770396 ] [ 1.6073422 3.4346063 2.9552516 ] [ 3.9893207 1.1851994 2.3142487 ] [ 4.7375585 1.7253888 4.6319122 ] [ 3.9685888 3.4967253 3.1211221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5770791e-10 1.3267843e-10 1.8885951e-10 ] [ 2.2926138e-10 3.681239e-11 3.9876226e-10 ] [ 2.4819819e-10 2.5191307e-10 4.9770396e-10 ] [ 1.6073422e-10 3.4346063e-10 2.9552516e-10 ] [ 3.9893207e-10 1.1851994e-10 2.3142487e-10 ] [ 4.737558499999999e-10 1.7253888e-10 4.6319122e-10 ] [ 3.9685888e-10 3.4967253e-10 3.1211221e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.3328911 0.0811159 0.4403884 ] [ 0.1046373 0.1460904 -0.4224077 ] [ -0.1202916 -0.2291145 0.2045197 ] [ -0.1302202 0.115022 -0.0186344 ] [ -0.1257239 -0.1526809 0.2412435 ] [ -0.2567661 0.2527891 -0.2698025 ] [ 0.1954734 -0.213222 -0.1753071 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.333503376923949e-10 1.299619985551507e-10 7.055799985515188e-10 ] [ 1.676474357236359e-10 2.340626234033203e-10 -6.767717413859002e-10 ] [ -1.927283891986253e-10 -3.670818953862816e-10 3.276766818330298e-10 ] [ -2.086357599959002e-10 1.842855592776576e-10 -2.985560002263552e-11 ] [ -2.014318932557971e-10 -2.446217684227028e-10 3.865146956199648e-10 ] [ -4.113846424339949e-10 4.050127860130733e-10 -4.32271257733392e-10 ] [ 3.131829114682867e-10 -3.416193034402176e-10 -2.808729370802477e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.873055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.504449734647255e-18 } }