{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.350826 0.4418416 2.50309 ] [ 1.033244 1.643774 1.864586 ] [ 1.591632 0.5864069 0.4139953 ] [ 2.819906 0.5589855 2.733529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.350826e-10 4.418416e-11 2.50309e-10 ] [ 1.033244e-10 1.643774e-10 1.864586e-10 ] [ 1.591632e-10 5.864069e-11 4.139953e-11 ] [ 2.819906e-10 5.589855000000001e-11 2.733529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1198.8600961 -5889.0371209 2599.7538589 ] [ -1525.698698 5725.5027957 -2940.6357732 ] [ 30.5509935 -52.3402095 -78.5406788 ] [ 2694.0078006 215.8745348 419.422593 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.920785617581461e-06 -9.435277594129324e-06 4.165264852564163e-06 ] [ -2.4444387843206e-06 9.173266721595578e-06 -4.711417886109172e-06 ] [ 4.894808752791277e-08 -8.385825998867407e-08 -1.258360393551222e-07 ] [ 4.316276314374148e-06 3.45869132682636e-07 6.719890727399137e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 1021.5424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.636691350435922e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.9106149 -0.0641643 2.561826 ] [ 1.1506328 2.0506765 1.930745 ] [ 1.7975202 0.4097759 0.5826332 ] [ 2.9368401 0.8347198 2.4399961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.106149e-11 -6.41643e-12 2.561826e-10 ] [ 1.1506328e-10 2.0506765e-10 1.930745e-10 ] [ 1.7975202e-10 4.097759e-11 5.826332e-11 ] [ 2.9368401e-10 8.347198e-11 2.4399961e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -1.03e-05 6e-07 ] [ -3e-06 1.36e-05 -2e-07 ] [ 3e-07 -4.2e-06 -1e-06 ] [ 8.5e-06 1e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.292624400640001e-15 -1.650241919424e-14 9.6130597248e-16 ] [ -4.8065298624e-15 2.178960204288e-14 -3.2043532416e-16 ] [ 4.8065298624e-16 -6.72914180736e-15 -1.6021766208e-15 ] [ 1.36185012768e-14 1.6021766208e-15 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.027265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.048503914076612e-18 } }