{ "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" [ [ 2.191031021000556e-10 8.512540695871739e-10 8.305231856845212e-10 ] [ -1.895895505210386e-09 7.916194530930599e-12 2.547103402452954e-09 ] [ 3.513504624984401e-09 -2.745422588603772e-10 -1.736485499051586e-09 ] [ 1.375264202550501e-09 1.114094350748142e-10 -5.005515433412898e-10 ] [ -3.211976424424571e-09 -6.960376005502048e-10 -1.1405895457446e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.00256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.923022118018304e-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" [ [ -1.29776307354e-14 -2.8038091095e-14 1.10550187746e-14 ] [ -4.6463122386e-15 1.00937127942e-14 -5.06287816344e-14 ] [ -7.0495771896e-15 9.2926244772e-15 1.2016324755e-14 ] [ 1.81045959642e-14 3.204353268e-16 2.43530848368e-14 ] [ 6.568924199399999e-15 8.331318496799998e-15 3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }