{ "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" [ [ 1.331987 2.725643 2.897481 ] [ 2.736578 2.541304 1.125105 ] [ 1.73273 1.005545 4.481047 ] [ 2.473311 4.730527 2.221702 ] [ 3.99816 2.852734 3.21894 ] [ 4.698265 3.839392 1.5336 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.331987e-10 2.725643e-10 2.897481e-10 ] [ 2.736578e-10 2.541304e-10 1.125105e-10 ] [ 1.73273e-10 1.005545e-10 4.481047e-10 ] [ 2.473311e-10 4.730527000000001e-10 2.221702e-10 ] [ 3.99816e-10 2.852734e-10 3.21894e-10 ] [ 4.698265e-10 3.839392e-10 1.5336e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7743647 -0.1170679 0.5889321 ] [ -0.5216272 -1.7956093 -2.9897043 ] [ -0.3085963 -1.4775937 1.3961737 ] [ -1.0563659 3.1909724 0.0245535 ] [ 1.8242463 -1.0022941 2.5997914 ] [ 2.8367077 1.2015926 -1.6197464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.445022259912807e-09 -1.875634524261523e-10 9.435732418586476e-10 ] [ -8.357389046133657e-10 -2.876883240551053e-09 -4.79003433256523e-09 ] [ -4.94425777125383e-10 -2.367366081181369e-09 2.236916860715833e-09 ] [ -1.692484747990351e-09 5.112501376898066e-09 3.933904365881279e-11 ] [ 2.922764772440903e-09 -1.605852174185777e-09 4.165325000036901e-09 ] [ 4.54490675698334e-09 1.925163571446286e-09 -2.595119813704965e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.846167 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.897965181349247e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.2973489 2.9033068 3.0580295 ] [ 2.5399717 1.2989458 -0.5701898 ] [ 1.3777198 -1.0195573 5.8342919 ] [ 2.2461461 7.0276619 2.2313862 ] [ 5.3309894 2.6876956 4.8973098 ] [ 6.7735529 4.7970922 0.0270475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.2973489e-10 2.903306800000001e-10 3.0580295e-10 ] [ 2.5399717e-10 1.2989458e-10 -5.701898e-11 ] [ 1.3777198e-10 -1.0195573e-10 5.8342919e-10 ] [ 2.2461461e-10 7.0276619e-10 2.2313862e-10 ] [ 5.3309894e-10 2.6876956e-10 4.8973098e-10 ] [ 6.7735529e-10 4.7970922e-10 2.70475e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 4.4408921e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.115093498115416e-35 } }