{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8571911 7.1147853 10.9058519 ] [ 0.0 0.0 0.0 ] [ 4.2885326 -5.8257448 -9.4683228 ] [ 1.0815933 -2.5323682 -0.6979826 ] [ -2.5129348 1.2433277 -0.7395466 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.577724781577835e-09 1.139914266967151e-08 1.747310094408726e-08 ] [ 0.0 0.0 0.0 ] [ 6.870986669258638e-09 -9.333872117307171e-09 -1.516992542834759e-08 ] [ 1.732903498473921e-09 -4.057301125297379e-09 -1.118291403445198e-09 ] [ -4.026165386154724e-09 1.992030572933036e-09 -1.184884272512129e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6728403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.486715481392058e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6347064 3.3665806 2.0324257 ] [ 2.042679 1.03426 3.627522 ] [ -0.2118947 3.5063227 3.2198595 ] [ 5.2667798 1.1882685 2.3297211 ] [ 3.7216234 2.6792382 1.8510278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6347064e-10 3.3665806e-10 2.0324257e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ -2.118947e-11 3.5063227e-10 3.2198595e-10 ] [ 5.2667798e-10 1.1882685e-10 2.3297211e-10 ] [ 3.7216234e-10 2.6792382e-10 1.8510278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.5991439 -0.1690065 -0.0071612 ] [ 0.0 0.0 0.0 ] [ -0.1149823 0.0453579 -0.0064197 ] [ 0.1198027 -0.0234226 -0.0204227 ] [ -0.6039643 0.1470711 0.0340037 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.59934349074933e-10 -2.707782630632352e-10 -1.147350721687296e-11 ] [ 0.0 0.0 0.0 ] [ -1.842219528658118e-10 7.267136694858433e-11 -1.028549325254976e-11 ] [ 1.919450850487161e-10 -3.752714211835008e-11 -3.272077247361216e-11 ] [ -9.676574812578376e-10 2.356338780153389e-10 5.447993316069696e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.3688246 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.340833511769591e-18 } }