{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 461.2402473 -841.5209285 -2039.578971 ] [ -526.5442097 838.7866136 2004.9131841 ] [ -1.8482223 5.0268951 4.180063 ] [ -2.5086845 2.2703599 -4.1284557 ] [ 69.6608692 -4.5629402 34.6141795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.389883407960705e-07 -1.348265157556608e-06 -3.267765743611521e-06 ] [ -8.436168225989527e-07 1.343884302149923e-06 3.212225030298706e-06 ] [ -2.961178559101204e-09 8.053973804434079e-09 6.697199212071111e-09 ] [ -4.019355654863338e-09 3.637517552581826e-09 -6.614515202548499e-09 ] [ 1.116090160168468e-07 -7.310636110548476e-09 5.545802914307464e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 245.14932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.927725091090179e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7289177 2.6367428 -0.1049739 ] [ 0.2044852 1.9365881 1.9303563 ] [ 1.5517541 0.7215792 0.6452945 ] [ 1.9513122 0.9019183 2.8168477 ] [ 2.2641061 2.6498252 1.492161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.289177000000001e-11 2.6367428e-10 -1.049739e-11 ] [ 2.044852e-11 1.9365881e-10 1.9303563e-10 ] [ 1.5517541e-10 7.215792e-11 6.452945e-11 ] [ 1.9513122e-10 9.019183e-11 2.8168477e-10 ] [ 2.2641061e-10 2.6498252e-10 1.492161e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 1e-07 6.9e-06 ] [ -4.2e-06 -8.5e-06 -2.26e-05 ] [ -1.77e-05 2.5e-06 -6.2e-06 ] [ 1.11e-05 -6.6e-06 2.45e-05 ] [ 1.39e-05 1.26e-05 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 1.6021766208e-16 1.105501868352e-14 ] [ -6.72914180736e-15 -1.36185012768e-14 -3.620919163008e-14 ] [ -2.835852618816e-14 4.005441552e-15 -9.93349504896e-15 ] [ 1.778416049088e-14 -1.057436569728e-14 3.92533272096e-14 ] [ 2.227025502912e-14 2.018742542208e-14 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }