{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.00876e-11 6.867454e-11 2.5513454e-10 ] [ 8.212163000000001e-11 2.1571709e-10 7.692658e-11 ] [ 3.1050621e-10 2.401165e-10 3.630652e-11 ] ] "source-value" [ [ 0.500876 0.6867454 2.5513454 ] [ 0.8212163 2.1571709 0.7692658 ] [ 3.1050621 2.401165 0.3630652 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.1052600797312e-13 8.972189076479999e-15 -2.130894905664e-14 ] [ -4.2874246372608e-13 1.0189843308288e-13 -1.0109734477248e-13 ] [ 2.1821645575296e-13 -1.1087062215936e-13 1.2240629382912e-13 ] ] "source-value" [ [ 0.0001314 5.6e-06 -1.33e-05 ] [ -0.0002676 6.36e-05 -6.31e-05 ] [ 0.0001362 -6.92e-05 7.64e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.795699148443393e-19 "source-value" -2.99324 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.461098720849739e-09 -3.285207405203996e-09 4.01842302785237e-09 ] [ -4.334892484222904e-09 2.314667127552353e-09 -2.565559815268867e-09 ] [ 5.795991205072642e-09 9.705401174339809e-10 -1.452863212583503e-09 ] ] "source-value" [ [ -0.9119461 -2.0504652 2.5081024 ] [ -2.7056271 1.4447016 -1.6012965 ] [ 3.6175732 0.6057635 -0.9068059 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.440255484199323e-19 "source-value" -2.1472386 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.325457e-11 8.627304e-11 2.318578e-10 ] [ 6.796957000000001e-11 2.260206e-10 6.525144000000001e-11 ] [ 2.814913e-10 2.122145e-10 7.12584e-11 ] ] "source-value" [ [ 0.9325457 0.8627304 2.318578 ] [ 0.6796957 2.260206 0.6525144 ] [ 2.814913 2.122145 0.712584 ] ] } "instance-id" 1 }