{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.7262896 6.2188326 13.3510634 ] [ 2.3714525 -8.4489444 -6.8303232 ] [ 4.863941 -18.9859399 17.560571 ] [ -2.8546119 2.6179696 -27.401904 ] [ 17.345508 18.5980821 3.3205927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.480935325385018e-08 9.963668200388878e-09 2.139076164229856e-08 ] [ 3.799485752837713e-09 -1.353670118811908e-08 -1.094338414354784e-08 ] [ 7.792892555150573e-09 -3.041882903169389e-08 2.813513630409848e-08 ] [ -4.573592447637468e-09 4.194449687085128e-09 -4.3902689954206e-08 ] [ 2.779056739349937e-08 2.979741233233897e-08 5.320175991139148e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.0131549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.283848943962896e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1939672 2.6915015 3.5052655 ] [ 2.4918546 0.2367952 0.9031862 ] [ 1.6705241 0.4245641 3.0989491 ] [ 2.5220409 2.3875678 -0.0478718 ] [ 1.7193366 3.904579 1.5601032 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1939672e-10 2.6915015e-10 3.5052655e-10 ] [ 2.4918546e-10 2.367952e-11 9.031862000000001e-11 ] [ 1.6705241e-10 4.245641e-11 3.0989491e-10 ] [ 2.5220409e-10 2.3875678e-10 -4.78718e-12 ] [ 1.7193366e-10 3.904579e-10 1.5601032e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.68e-05 5.68e-05 2.82e-05 ] [ 9.3e-06 5.4e-06 -5.89e-05 ] [ 2.41e-05 -6.73e-05 4.53e-05 ] [ -1.18e-05 -1.07e-05 2.4e-06 ] [ 3.53e-05 1.58e-05 -1.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.100363206143999e-14 9.100363206143999e-14 4.518138070656001e-14 ] [ 1.490024257344e-14 8.65175375232e-15 -9.436820296512001e-14 ] [ 3.861245656128e-14 -1.0782648657984e-13 7.257860092224001e-14 ] [ -1.890568412544e-14 -1.714328984256e-14 3.84522388992e-15 ] [ 5.655683471424e-14 2.531439060864e-14 -2.72370025536e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }