{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2671109 -0.0206161 -2.4594972 ] [ -0.394618 -1.1992767 3.0894353 ] [ -4.1152406 0.745223 -2.9202112 ] [ 1.9655327 4.6396899 1.0778046 ] [ 1.2772149 -4.16502 1.2124685 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.030135476666711e-09 -3.30306337042074e-11 -3.940548945228425e-09 ] [ -6.32247738955812e-10 -1.921453106440628e-09 4.94982104991478e-09 ] [ -6.593342332608139e-09 1.193978877719382e-09 -4.6786941509851e-09 ] [ 3.149130565302932e-09 7.433602746785795e-09 1.726833346137716e-09 ] [ 2.046323869376646e-09 -6.67309772414268e-09 1.942588700161028e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.206153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.9556413127629e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3529862 1.8628514 1.2016552 ] [ 1.0564375 1.7548498 3.3929731 ] [ 0.4761265 3.4049752 1.6490617 ] [ 2.5745227 3.7433621 2.9072904 ] [ 3.5131649 1.5024066 3.3522306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3529862e-10 1.8628514e-10 1.2016552e-10 ] [ 1.0564375e-10 1.7548498e-10 3.3929731e-10 ] [ 4.761265e-11 3.4049752e-10 1.6490617e-10 ] [ 2.5745227e-10 3.7433621e-10 2.9072904e-10 ] [ 3.5131649e-10 1.5024066e-10 3.3522306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 4.4e-06 -2.18e-05 ] [ 4e-06 3.39e-05 1.8e-05 ] [ 2.21e-05 -7.5e-06 -3.9e-06 ] [ -3.72e-05 -2.66e-05 1.21e-05 ] [ 1.22e-05 -4.2e-06 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.7623942974e-15 7.0495771896e-15 -3.492745062119999e-14 ] [ 6.408706535999999e-15 5.431378789259999e-14 2.8839179412e-14 ] [ 3.54081036114e-14 -1.2016324755e-14 -6.248488872599999e-15 ] [ -5.96009707848e-14 -4.26178984644e-14 1.93863372714e-14 ] [ 1.95465549348e-14 -6.729141862799999e-15 -7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }