{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.4979859 -14.9328341 -29.0891735 ] [ -2.1416877 3.6095592 -2.854163 ] [ -33.549721 26.8130298 31.3152529 ] [ 12.4879164 5.8781761 2.0206514 ] [ 19.3730493 -39.8633298 1.3139399 ] [ 9.5038613 28.7727178 -17.4042179 ] [ 14.8245675 -10.277319 14.6977101 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.284139405304146e-08 -2.392503787441842e-08 -4.6605994084072e-08 ] [ -3.431361990265202e-09 5.783151409279732e-09 -4.572873268227342e-09 ] [ -5.37525790634191e-08 4.295920983230569e-08 5.017256648418074e-08 ] [ 2.000784786342539e-08 9.417876397957247e-09 3.237440458539388e-09 ] [ 3.103904691779006e-08 -6.386809555899589e-08 2.105163806260297e-09 ] [ 1.522686450763686e-08 4.609897615583588e-08 -2.788463125242454e-08 ] [ 2.375157565765579e-08 -1.646608036196425e-08 2.35483276955258e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.108674276367168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.138935182431233e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -20.4979859 -14.9328341 -29.0891735 ] [ -2.1416877 3.6095592 -2.854163 ] [ -33.549721 26.8130298 31.3152529 ] [ 12.4879164 5.8781761 2.0206514 ] [ 19.3730493 -39.8633298 1.3139399 ] [ 9.5038613 28.7727178 -17.4042179 ] [ 14.8245675 -10.277319 14.6977101 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.284139405304146e-08 -2.392503787441842e-08 -4.6605994084072e-08 ] [ -3.431361990265202e-09 5.783151409279732e-09 -4.572873268227342e-09 ] [ -5.37525790634191e-08 4.295920983230569e-08 5.017256648418074e-08 ] [ 2.000784786342539e-08 9.417876397957247e-09 3.237440458539388e-09 ] [ 3.103904691779006e-08 -6.386809555899589e-08 2.105163806260297e-09 ] [ 1.522686450763686e-08 4.609897615583588e-08 -2.788463125242454e-08 ] [ 2.375157565765579e-08 -1.646608036196425e-08 2.35483276955258e-08 ] ] } "relaxed-potential-energy" { "source-value" -7.108674276367168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.138935182431233e-18 } }