{ "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" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8381646 -6.7458395 1.7631196 ] [ -3.268183 9.8147216 -0.185233 ] [ -13.5320148 -4.4145716 -4.1399742 ] [ 10.3207885 1.1494443 -9.7645654 ] [ 7.3175739 0.1962453 12.326653 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.342887726502184e-09 -1.080802633456916e-08 2.824829002794248e-09 ] [ -5.236206395096006e-09 1.572491748718077e-08 -2.967759820006464e-10 ] [ -2.168067774487959e-08 -7.07292340836765e-09 -6.632969873955184e-09 ] [ 1.65357260429215e-08 1.841612784371822e-09 -1.56445583961526e-08 ] [ 1.172404582355628e-08 3.144196316018823e-10 1.974947524931418e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.4103805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.259678663532214e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8233326 1.7362812 2.570142 ] [ 1.6008017 4.9073076 0.5350649 ] [ 0.3797067 3.0859013 1.330727 ] [ 3.7991912 4.6831615 1.2823901 ] [ 3.9366089 2.7236245 2.5405518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8233326e-10 1.7362812e-10 2.570142e-10 ] [ 1.6008017e-10 4.9073076e-10 5.350648999999999e-11 ] [ 3.797067e-11 3.0859013e-10 1.330727e-10 ] [ 3.7991912e-10 4.6831615e-10 1.2823901e-10 ] [ 3.9366089e-10 2.7236245e-10 2.5405518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-05 2.9e-05 -1.55e-05 ] [ -1.49e-05 -2.99e-05 -0.0 ] [ 4.14e-05 1.3e-06 1.47e-05 ] [ -1e-06 2.92e-05 1.1e-06 ] [ -5.5e-06 -2.95e-05 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-14 4.64631220032e-14 -2.48337376224e-14 ] [ -2.387243164992e-14 -4.790508096192e-14 0.0 ] [ 6.633011210111999e-14 2.08282960704e-15 2.355199632576e-14 ] [ -1.6021766208e-15 4.678355732736e-14 1.76239428288e-15 ] [ -8.8119714144e-15 -4.72642103136e-14 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }