{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2466873 -2.9243868 -4.18961 ] [ -1.1239107 -1.4191672 1.2727026 ] [ -1.9790869 4.990626 0.2770288 ] [ 4.337672 -2.3869419 -4.0873123 ] [ 6.0120129 1.7398699 6.727191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.161047297030828e-08 -4.685384161136126e-09 -6.712495192269888e-09 ] [ -1.800703447406963e-09 -2.273756508846198e-09 2.039094350951374e-09 ] [ -3.170846761711548e-09 7.995864300356621e-09 4.438490666482791e-10 ] [ 6.949716667098778e-09 -3.824302507387932e-09 -6.548596208968276e-09 ] [ 9.632306512328009e-09 2.787578877013634e-09 1.077814814385617e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.607675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.57577929884464e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9238585 2.3526197 1.3379209 ] [ 2.2798811 1.5143023 3.7273093 ] [ 2.5880686 4.5826831 2.3982737 ] [ 4.4609222 2.0515637 1.2311821 ] [ 4.2953855 3.0797533 3.566594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9238585e-10 2.3526197e-10 1.3379209e-10 ] [ 2.2798811e-10 1.5143023e-10 3.7273093e-10 ] [ 2.5880686e-10 4.5826831e-10 2.3982737e-10 ] [ 4.4609222e-10 2.0515637e-10 1.2311821e-10 ] [ 4.2953855e-10 3.0797533e-10 3.566594e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.5e-06 -3e-07 1.8e-06 ] [ 3.4e-06 9.7e-06 2e-06 ] [ -5e-06 4e-07 2.8e-06 ] [ 2e-07 1.5e-06 1.5e-06 ] [ -7e-06 -1.13e-05 -8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.36185012768e-14 -4.8065298624e-16 2.88391791744e-15 ] [ 5.44740051072e-15 1.554111322176e-14 3.2043532416e-15 ] [ -8.010883104e-15 6.408706483200001e-16 4.48609453824e-15 ] [ 3.2043532416e-16 2.4032649312e-15 2.4032649312e-15 ] [ -1.12152363456e-14 -1.810459581504e-14 -1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }