{ "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" [ [ 1.635666 1.500837 2.371006 ] [ 1.689283 2.814467 0.5645773 ] [ 2.46942 4.224913 2.374581 ] [ 3.374683 1.495269 0.2101847 ] [ 3.693559 1.840027 2.268425 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.635666e-10 1.500837e-10 2.371006e-10 ] [ 1.689283e-10 2.814467e-10 5.645773e-11 ] [ 2.46942e-10 4.224913e-10 2.374581e-10 ] [ 3.374683e-10 1.495269e-10 2.101847e-11 ] [ 3.693559e-10 1.840027e-10 2.268425e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5613456 -3.188883 4.7611022 ] [ -4.7759793 4.6474801 -4.1628895 ] [ 0.2566185 1.0497657 0.5937552 ] [ 3.6534887 -3.0155478 -6.7520108 ] [ 7.4272178 0.5071851 5.5600429 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.051243452130895e-08 -5.109153789066566e-09 7.628126634079445e-09 ] [ -7.65196237588475e-09 7.446083961853246e-09 -6.669684231873802e-09 ] [ 4.111481611647649e-10 1.681910061857747e-09 9.513006999184282e-10 ] [ 5.853534179496985e-09 -4.831440184064874e-09 -1.08179138471491e-08 ] [ 1.189971471674961e-08 8.126001096381102e-10 8.908170745025031e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8461343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.417306955991697e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5524838 1.4408958 2.3244435 ] [ 1.551795 3.1207145 0.2927263 ] [ 2.4417201 3.9194369 2.4499614 ] [ 3.2133438 1.2978697 0.2822027 ] [ 4.1032682 2.0965962 2.4394401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5524838e-10 1.4408958e-10 2.3244435e-10 ] [ 1.551795e-10 3.1207145e-10 2.927263e-11 ] [ 2.4417201e-10 3.9194369e-10 2.4499614e-10 ] [ 3.2133438e-10 1.2978697e-10 2.822027e-11 ] [ 4.1032682e-10 2.0965962e-10 2.4394401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 -1.2e-06 -4.2e-06 ] [ 8.6e-06 -1.8e-05 -8.2e-06 ] [ 5.7e-06 6.1e-06 1.1e-05 ] [ -1.27e-05 1.33e-05 5.5e-06 ] [ -5.1e-06 -2e-07 -4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 -1.92261194496e-15 -6.72914180736e-15 ] [ 1.377871893888e-14 -2.88391791744e-14 -1.313784829056e-14 ] [ 9.13240673856e-15 9.77327738688e-15 1.76239428288e-14 ] [ -2.034764308416e-14 2.130894905664e-14 8.8119714144e-15 ] [ -8.17110076608e-15 -3.2043532416e-16 -6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }