{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.349925 1.341612 0.6560134 ] [ 0.6162161 0.8811692 2.732129 ] [ 2.287058 0.0970069 0.7690432 ] [ 2.096073 0.9342159 2.106012 ] [ 2.754629 2.399765 1.157711 ] [ 1.653705 1.889806 0.0543731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.49925e-11 1.341612e-10 6.560134e-11 ] [ 6.162161e-11 8.811692000000001e-11 2.732129e-10 ] [ 2.287058e-10 9.70069e-12 7.690432000000001e-11 ] [ 2.096073e-10 9.342159e-11 2.106012e-10 ] [ 2.754629e-10 2.399765e-10 1.157711e-10 ] [ 1.653705e-10 1.889806e-10 5.43731e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.5493905 -22.7058158 18.1272717 ] [ -40.7406375 -4.6952807 31.5542697 ] [ 3.6192223 -31.4412471 -33.527872 ] [ 19.5192572 18.3138404 15.9849315 ] [ 29.8529368 21.4501675 18.5639729 ] [ 15.2986117 19.0783357 -50.7025738 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.413898937638963e-08 -3.637872723095125e-08 2.904309091662948e-08 ] [ -6.527369691898776e-08 -7.522668965633457e-09 5.055551319975783e-08 ] [ 5.798633354538004e-09 -5.03744310324158e-08 -5.371757266357494e-08 ] [ 3.127329754122207e-08 2.934200692594252e-08 2.561068353438947e-08 ] [ 4.782967740317997e-08 3.436695688074398e-08 2.974276336954478e-08 ] [ 2.451107799643734e-08 3.0566863422314e-08 -8.123447835674662e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.682271 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.313665106124984e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3362302 1.5846787 0.8225245 ] [ 0.2094814 0.9635096 2.6756599 ] [ 2.6668008 -0.48989 0.3538164 ] [ 2.5314077 0.7617554 2.5688859 ] [ 3.0170737 2.9801877 1.4138416 ] [ 1.6690727 1.7433337 -0.3594465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.362302e-11 1.5846787e-10 8.225245e-11 ] [ 2.094814e-11 9.635096e-11 2.6756599e-10 ] [ 2.6668008e-10 -4.8989e-11 3.538164e-11 ] [ 2.5314077e-10 7.617554e-11 2.5688859e-10 ] [ 3.0170737e-10 2.9801877e-10 1.4138416e-10 ] [ 1.6690727e-10 1.7433337e-10 -3.594465e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 2.51e-05 -5.93e-05 ] [ 2.07e-05 -8.4e-06 2.48e-05 ] [ -6.4e-06 2.19e-05 1e-07 ] [ 1.1e-05 -1.59e-05 -6.3e-06 ] [ -1.11e-05 3.5e-06 -1.34e-05 ] [ -4.5e-06 -2.62e-05 5.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.554111322176e-14 4.021463318208e-14 -9.500907361344e-14 ] [ 3.316505605055999e-14 -1.345828361472e-14 3.973398019584e-14 ] [ -1.025393037312e-14 3.508766799552e-14 1.6021766208e-16 ] [ 1.76239428288e-14 -2.547460827072e-14 -1.009371271104e-14 ] [ -1.778416049088e-14 5.6076181728e-15 -2.146916671872e-14 ] [ -7.2097947936e-15 -4.197702746496e-14 8.667775518528e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642651340801e-18 } }