{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1197706 -1.6767125 -0.8494342 ] [ -10.4657278 2.3621401 -1.2343641 ] [ 2.113075 -3.4032101 -1.7452733 ] [ 4.8731989 5.950123 -4.3441074 ] [ 2.3596834 -3.2323405 8.173179 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.794070275979189e-09 -2.68638956730312e-09 -1.360943616147951e-09 ] [ -1.676794440081662e-08 3.784565643274174e-09 -1.977669302574833e-09 ] [ 3.385519362996959e-09 -5.452543657890431e-09 -2.796236078166465e-09 ] [ 7.807725346088278e-09 9.533147961484357e-09 -6.960027314524275e-09 ] [ 3.780629575969855e-09 -5.178780379564982e-09 1.309487631141352e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7538204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.082081314596211e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2166447 2.0338105 1.6033741 ] [ 2.7988404 4.0684468 2.9891383 ] [ 5.5368095 2.3167894 2.4816711 ] [ 5.0106214 4.7150344 2.0275751 ] [ 4.276214 2.8290139 4.5752764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2166447e-10 2.0338105e-10 1.6033741e-10 ] [ 2.7988404e-10 4.0684468e-10 2.9891383e-10 ] [ 5.536809500000001e-10 2.3167894e-10 2.4816711e-10 ] [ 5.0106214e-10 4.715034400000001e-10 2.0275751e-10 ] [ 4.276214000000001e-10 2.8290139e-10 4.5752764e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 9.9e-06 3.5e-06 ] [ 1.1e-05 -4.9e-06 2.7e-06 ] [ -6.3e-06 8.7e-06 4.1e-06 ] [ -6.3e-06 -1.08e-05 -5.7e-06 ] [ -4.6e-06 -2.8e-06 -4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.009371271104e-14 1.586154854592e-14 5.6076181728e-15 ] [ 1.76239428288e-14 -7.850665441919999e-15 4.32587687616e-15 ] [ -1.009371271104e-14 1.393893660096e-14 6.568924145279999e-15 ] [ -1.009371271104e-14 -1.730350750464e-14 -9.13240673856e-15 ] [ -7.370012455680001e-15 -4.48609453824e-15 -7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }