{ "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" [ [ 1.839564 1.867321 2.162261 ] [ 1.684665 2.737292 4.133334 ] [ 1.168876 4.298629 2.101191 ] [ 4.284365 2.457862 3.031672 ] [ 3.236614 0.5901118 4.309357 ] [ 3.135041 3.239997 1.121025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.839564e-10 1.867321e-10 2.162261e-10 ] [ 1.684665e-10 2.737292e-10 4.133334e-10 ] [ 1.168876e-10 4.298629e-10 2.101191e-10 ] [ 4.284365e-10 2.457862e-10 3.031672e-10 ] [ 3.236614e-10 5.901118e-11 4.309357e-10 ] [ 3.135041e-10 3.239997e-10 1.121025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3171548 -21.4577708 -7.1307611 ] [ -0.7512741 4.2976533 14.5526063 ] [ -2.2843523 8.3487751 -1.5058814 ] [ 3.1147677 -0.1867703 2.4968591 ] [ -0.2691264 -0.2691023 0.5109276 ] [ 6.50714 9.2672151 -8.9237506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.01211977305345e-08 -3.437913871024491e-08 -1.142473872293009e-08 ] [ -1.203673798832561e-09 6.88559964156397e-09 2.33158455855668e-08 ] [ -3.659935848730708e-09 1.337621227753718e-08 -2.412687972777573e-09 ] [ 4.990407988162988e-09 -2.992390081198023e-10 4.00040927545173e-09 ] [ -4.311880261200691e-10 -4.311494136635079e-10 8.185962556414541e-10 ] [ 1.042558757627251e-08 1.484771537314473e-08 -1.429742458116997e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.936174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.072603554540082e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8636594 1.4658901 1.9929578 ] [ 1.9923775 3.0746287 4.3830785 ] [ 1.0357706 4.0405686 2.1822962 ] [ 4.2887827 2.5485383 3.1172331 ] [ 2.8882177 0.535381 4.2383043 ] [ 3.2803172 3.5262061 0.9449701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8636594e-10 1.4658901e-10 1.9929578e-10 ] [ 1.9923775e-10 3.0746287e-10 4.3830785e-10 ] [ 1.0357706e-10 4.0405686e-10 2.1822962e-10 ] [ 4.2887827e-10 2.5485383e-10 3.1172331e-10 ] [ 2.8882177e-10 5.35381e-11 4.2383043e-10 ] [ 3.2803172e-10 3.5262061e-10 9.449701e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.74e-05 8.22e-05 1.97e-05 ] [ 8.7e-06 8.7e-06 -3.08e-05 ] [ -1.08e-05 -5.48e-05 -2.1e-06 ] [ -1.72e-05 -2.85e-05 -1.38e-05 ] [ 7e-07 -6.5e-06 7e-06 ] [ 1.1e-06 -1e-06 2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.787787320192e-14 1.3169891822976e-13 3.156287942976e-14 ] [ 1.393893660096e-14 1.393893660096e-14 -4.934703992064001e-14 ] [ -1.730350750464e-14 -8.779927881984e-14 -3.36457090368e-15 ] [ -2.755743787776e-14 -4.56620336928e-14 -2.211003736704e-14 ] [ 1.12152363456e-15 -1.04141480352e-14 1.12152363456e-14 ] [ 1.76239428288e-15 -1.6021766208e-15 3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.751018 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.164461927659998e-18 } }