{ "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" [ [ -9.4797828 -6.1133715 7.9713948 ] [ -8.430862 5.9703774 -8.1033485 ] [ 0.7539275 5.5675554 1.3504482 ] [ 5.9771113 -2.9432575 -9.3648594 ] [ 11.179606 -2.4813039 8.1463649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.518828637242196e-08 -9.794700891565028e-09 1.277158238372669e-08 ] [ -1.350772998959113e-08 9.56559908763269e-09 -1.298299551689475e-08 ] [ 1.207925014278192e-09 8.920207096888791e-09 2.163656533641443e-09 ] [ 9.576387984779495e-09 -4.715618355494257e-09 -1.500415878775912e-08 ] [ 1.79117033629554e-08 -3.975487097679861e-09 1.305191538728573e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.65989671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.057271080904838e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3263734 1.2247754 2.4972244 ] [ 1.3508909 2.861074 0.532373 ] [ 2.8200779 4.2100846 2.1324859 ] [ 3.5711107 1.6904389 0.0435547 ] [ 3.7941581 1.8891401 2.5831361 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3263734e-10 1.2247754e-10 2.4972244e-10 ] [ 1.3508909e-10 2.861074e-10 5.32373e-11 ] [ 2.8200779e-10 4.2100846e-10 2.1324859e-10 ] [ 3.5711107e-10 1.6904389e-10 4.355470000000001e-12 ] [ 3.7941581e-10 1.8891401e-10 2.5831361e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.13e-05 -6.7e-06 2.58e-05 ] [ -1.13e-05 3.6e-06 -6.6e-06 ] [ 4.4e-06 -3.9e-06 -7e-06 ] [ 2.31e-05 1.19e-05 -2.21e-05 ] [ 5e-06 -5e-06 9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.412636202304e-14 -1.073458335936e-14 4.133615681664e-14 ] [ -1.810459581504e-14 5.76783583488e-15 -1.057436569728e-14 ] [ 7.04957713152e-15 -6.24848882112e-15 -1.12152363456e-14 ] [ 3.701027994048e-14 1.906590178752e-14 -3.540810331968e-14 ] [ 8.010883104e-15 -8.010883104e-15 1.586154854592e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }