{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2624958 -13.4494131 1.6632125 ] [ -22.5855346 7.9473167 -0.9768049 ] [ 2.9742906 6.3285651 -3.7451977 ] [ 12.8706687 -5.1722851 -9.7120771 ] [ 9.0030712 4.3458164 12.7708671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.624917875418193e-09 -2.154833523230125e-08 2.66476018292232e-09 ] [ -3.618601550438948e-08 1.273300501483341e-08 -1.565013973862882e-09 ] [ 4.765338862785204e-09 1.013947904643082e-08 -6.000468195213932e-09 ] [ 2.062108448520233e-08 -8.28691426333219e-09 -1.556046286902706e-08 ] [ 1.44245101920378e-08 6.962765434369222e-09 2.04611846949639e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7926715 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.248523609087447e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2684627 0.1771388 2.3512832 ] [ 1.5727864 2.7412981 2.445934 ] [ 2.712137 3.7977762 0.4031202 ] [ 4.08349 1.8715009 1.4012164 ] [ 3.5796828 1.9700808 4.0097252 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2684627e-10 1.771388e-11 2.3512832e-10 ] [ 1.5727864e-10 2.7412981e-10 2.445934e-10 ] [ 2.712137e-10 3.7977762e-10 4.031202e-11 ] [ 4.08349e-10 1.8715009e-10 1.4012164e-10 ] [ 3.5796828e-10 1.9700808e-10 4.0097252e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.36e-05 -3.14e-05 1.5e-06 ] [ -4.05e-05 5.63e-05 4.3e-06 ] [ -1.33e-05 -4.5e-05 3.4e-05 ] [ 8e-05 2.31e-05 -3.57e-05 ] [ -2.6e-06 -2.9e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.781136825088e-14 -5.030834589312e-14 2.4032649312e-15 ] [ -6.488815314240001e-14 9.020254375104e-14 6.889359469440001e-15 ] [ -2.130894905664e-14 -7.209794793600001e-14 5.44740051072e-14 ] [ 1.28174129664e-13 3.701027994048e-14 -5.719770536256001e-14 ] [ -4.16565921408e-15 -4.646312200320001e-15 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.801245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.53163853185329e-18 } }