{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 34.8783769 -599.1973331 3.2459052 ] [ -277.2373721 565.3864058 117.735637 ] [ 5.8531727 48.6098757 -86.603893 ] [ 236.5058225 -14.7989484 -34.3776492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.588132004063078e-08 -9.600199583385302e-07 5.200513424773149e-09 ] [ -4.441832359906503e-07 9.058488810909016e-07 1.886332850363954e-07 ] [ 9.377816457444812e-09 7.788160638653404e-08 -1.387547326348648e-07 ] [ 3.789240994925746e-07 -2.371052913890557e-08 -5.507906582630383e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 317.41611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.085566705072811e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7710297 -0.412211 3.0396702 ] [ 0.1391335 2.5924681 2.4500807 ] [ 2.1297129 3.2084847 0.1191837 ] [ 3.2651876 1.3458199 2.3588641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.710297e-11 -4.12211e-11 3.0396702e-10 ] [ 1.391335e-11 2.5924681e-10 2.4500807e-10 ] [ 2.1297129e-10 3.2084847e-10 1.191837e-11 ] [ 3.2651876e-10 1.3458199e-10 2.3588641e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.4e-06 3.98e-05 -2.1e-06 ] [ -6.13e-05 -1.04e-05 9.4e-06 ] [ 1.56e-05 -2.4e-06 8.7e-06 ] [ 3.64e-05 -2.7e-05 -1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.506046023552e-14 6.376662950784e-14 -3.36457090368e-15 ] [ -9.821342685504e-14 -1.666263685632e-14 1.506046023552e-14 ] [ 2.499395528448e-14 -3.84522388992e-15 1.393893660096e-14 ] [ 5.831922899712e-14 -4.32587687616e-14 -2.56348259328e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.4802818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358690923775574e-18 } }