{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.5099727 -0.5505553 -35.817874 ] [ -281.745905 -185.3125095 183.7246146 ] [ -2.3637022 -2.2614411 3.2676255 ] [ -482.1462432 362.8045935 -868.8673846 ] [ 786.7658231 -174.6800877 717.6930185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.286059875318625e-08 -8.820868301175302e-10 -5.738656032956019e-08 ] [ -4.514067019971378e-07 -2.969033702626779e-07 2.943592821776104e-07 ] [ -3.787068403373526e-09 -3.623228059736235e-09 5.235313181629911e-09 ] [ -7.72483438661591e-07 5.812770376245476e-07 -1.392079010181762e-06 ] [ 1.260537807815289e-06 -2.798683526322337e-07 1.149870975152082e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 140.9963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.25900975479303e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1687752 1.014981 0.5279111 ] [ 1.3113921 1.3015953 2.4041031 ] [ 2.3153666 0.4723486 0.6021181 ] [ 1.7025487 2.6089404 0.6489386 ] [ 3.3840982 1.9069392 1.9088597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.687752e-11 1.014981e-10 5.279111e-11 ] [ 1.3113921e-10 1.3015953e-10 2.4041031e-10 ] [ 2.3153666e-10 4.723486e-11 6.021181e-11 ] [ 1.7025487e-10 2.6089404e-10 6.489386e-11 ] [ 3.3840982e-10 1.9069392e-10 1.9088597e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.9e-06 2.34e-05 3.04e-05 ] [ 2.05e-05 -3.24e-05 -2.42e-05 ] [ 3.1e-06 -1.44e-05 2.3e-06 ] [ 1.14e-05 5.9e-06 -3.04e-05 ] [ -2.82e-05 1.75e-05 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.105501868352e-14 3.749093292672001e-14 4.870616927232e-14 ] [ 3.28446207264e-14 -5.191052251392001e-14 -3.877267422336e-14 ] [ 4.96674752448e-15 -2.307134333952e-14 3.68500622784e-15 ] [ 1.826481347712e-14 9.45284206272e-15 -4.870616927232e-14 ] [ -4.518138070656001e-14 2.8038090864e-14 3.508766799552e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }