{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2044989 -2.5801917 -4.8223702 ] [ -8.4945484 2.5382163 32.6600433 ] [ -14.2262642 6.4798233 -8.6607253 ] [ -5.6098331 -32.4849216 -5.7898492 ] [ 16.4258847 2.142736 -21.8634151 ] [ -10.0167328 20.1036892 4.0319704 ] [ 30.1259927 3.8006484 4.444346 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.31450564312587e-08 -4.133922852980737e-09 -7.726288854937905e-09 ] [ -1.360976696286208e-08 4.066670847897934e-09 5.232715824068824e-08 ] [ -2.27929880903507e-08 1.038182148370877e-08 -1.387601170915264e-08 ] [ -8.987943513459785e-09 -5.204658234484188e-08 -9.276361102623593e-09 ] [ 2.63171686591181e-08 3.433041552030624e-09 -3.502905281266277e-08 ] [ -1.604857524118139e-08 3.220966109343815e-08 6.459928763859633e-09 ] [ 4.826716157999457e-08 6.089310060529484e-09 7.120627314611364e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5615155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.706176915728827e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6919585 2.3840357 1.5868695 ] [ 2.4393897 2.5520547 5.1117 ] [ 1.2165473 4.0116866 3.4557591 ] [ 3.4694043 1.2111472 3.111543 ] [ 4.1440889 3.2963408 1.4671184 ] [ 3.3276018 5.2971737 2.946849 ] [ 4.7118414 3.4239673 4.1445781 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6919585e-10 2.3840357e-10 1.5868695e-10 ] [ 2.4393897e-10 2.5520547e-10 5.1117e-10 ] [ 1.2165473e-10 4.0116866e-10 3.4557591e-10 ] [ 3.4694043e-10 1.2111472e-10 3.111543e-10 ] [ 4.1440889e-10 3.2963408e-10 1.4671184e-10 ] [ 3.3276018e-10 5.297173700000001e-10 2.946849e-10 ] [ 4.711841400000001e-10 3.4239673e-10 4.144578100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.74e-05 -1.38e-05 1.8e-05 ] [ 8.7e-06 -1.09e-05 -3.9e-06 ] [ 9.4e-06 1.25e-05 -3.3e-06 ] [ -1.83e-05 5.8e-06 -3.4e-06 ] [ 7.7e-06 1.04e-05 2.1e-05 ] [ -1.04e-05 7.1e-06 -7.2e-06 ] [ -1.45e-05 -1.11e-05 -2.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.78778734316e-14 -2.21100375492e-14 2.8839179412e-14 ] [ 1.39389367158e-14 -1.74637253106e-14 -6.248488872599999e-15 ] [ 1.50604603596e-14 2.0027207925e-14 -5.2871828922e-15 ] [ -2.93198324022e-14 9.2926244772e-15 -5.4474005556e-15 ] [ 1.23367600818e-14 1.66626369936e-14 3.364570931399999e-14 ] [ -1.66626369936e-14 1.13754541014e-14 -1.15356717648e-14 ] [ -2.3231561193e-14 -1.77841606374e-14 -3.41263623042e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.044153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.8522980120921e-18 } }