{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1367534 0.531311 0.5183718 ] [ -1.1833249 0.0049409 1.5897769 ] [ 2.1929571 -0.1713558 -1.083829 ] [ 0.8583724 0.0695363 -0.3124197 ] [ -2.004758 -0.4344325 -0.7119 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.191031002949107e-10 8.512540625738688e-10 8.305231788420135e-10 ] [ -1.895895489590498e-09 7.91619446571072e-12 2.5471033814679e-09 ] [ 3.513504596037368e-09 -2.745422565984807e-10 -1.736485484745043e-09 ] [ 1.375264191219986e-09 1.11409434156935e-10 -5.005515392173499e-10 ] [ -3.211976397961766e-09 -6.960375948156959e-10 -1.14058953634752e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.00256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.923022102174925e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0719161 1.9144992 0.3114161 ] [ 1.8112115 1.8342374 2.5862527 ] [ 3.1205123 0.7968334 0.8723723 ] [ 1.8633631 3.9068427 1.3906543 ] [ 3.9119631 2.7891803 1.9516124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0719161e-10 1.9144992e-10 3.114161e-11 ] [ 1.8112115e-10 1.8342374e-10 2.5862527e-10 ] [ 3.1205123e-10 7.968334e-11 8.723723e-11 ] [ 1.8633631e-10 3.9068427e-10 1.3906543e-10 ] [ 3.9119631e-10 2.7891803e-10 1.9516124e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.1e-06 -1.75e-05 6.9e-06 ] [ -2.9e-06 6.3e-06 -3.16e-05 ] [ -4.4e-06 5.8e-06 7.5e-06 ] [ 1.13e-05 2e-07 1.52e-05 ] [ 4.1e-06 5.2e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.297763062848e-14 -2.8038090864e-14 1.105501868352e-14 ] [ -4.646312200320001e-15 1.009371271104e-14 -5.062878121728e-14 ] [ -7.04957713152e-15 9.292624400640001e-15 1.2016324656e-14 ] [ 1.810459581504e-14 3.2043532416e-16 2.435308463616e-14 ] [ 6.568924145279999e-15 8.33131842816e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }