{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.127389 1.171603 0.6946463 ] [ 1.009133 1.283908 2.574652 ] [ 0.7652821 2.93985 0.2651139 ] [ 0.0212665 2.421916 2.924129 ] [ 2.909562 0.955426 0.4927479 ] [ 2.967895 0.4293313 2.317144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.127389e-10 1.171603e-10 6.946463000000001e-11 ] [ 1.009133e-10 1.283908e-10 2.574652e-10 ] [ 7.652821e-11 2.93985e-10 2.651139e-11 ] [ 2.12665e-12 2.421916e-10 2.924129e-10 ] [ 2.909562e-10 9.55426e-11 4.927479e-11 ] [ 2.967895e-10 4.293313e-11 2.317144e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5971832 -4.0603026 -12.3475935 ] [ 0.4393189 -5.573944 6.4355878 ] [ 2.0871486 2.0028289 0.389511 ] [ -6.5935131 8.9553379 3.1579759 ] [ 3.8638109 3.5210445 -6.7482832 ] [ 9.8004178 -4.8449647 9.112802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.537638254857453e-08 -6.505321899093454e-09 -1.978302562884205e-08 ] [ 7.038664706555731e-10 -8.930442762448436e-09 1.031094831426571e-08 ] [ 3.343980691055451e-09 3.208885639042581e-09 6.240654177444288e-10 ] [ -1.056397253775853e-08 1.434803301474417e-08 5.059635156029839e-09 ] [ 6.190507491172206e-09 5.641335178696425e-09 -1.081194157357741e-08 ] [ 1.570200027323217e-08 -7.762489170941286e-09 1.460031831437948e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3390575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.01562897244069e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0051001 1.0627156 0.2486704 ] [ 0.9385017 0.8016262 2.6848097 ] [ 0.1693272 3.2442279 0.5160903 ] [ 0.1055849 2.9950213 2.8406606 ] [ 3.322763 0.6736702 0.3267954 ] [ 3.2592507 0.4247731 2.6514067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0051001e-10 1.0627156e-10 2.486704e-11 ] [ 9.385017e-11 8.016262e-11 2.6848097e-10 ] [ 1.693272e-11 3.2442279e-10 5.160903e-11 ] [ 1.055849e-11 2.9950213e-10 2.8406606e-10 ] [ 3.322763e-10 6.736702000000001e-11 3.267954e-11 ] [ 3.2592507e-10 4.247731e-11 2.6514067e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 -2e-06 2.2e-05 ] [ 5.5e-06 6.56e-05 1.46e-05 ] [ 2e-07 1.18e-05 -3.04e-05 ] [ 1.55e-05 -7.05e-05 -1.29e-05 ] [ -2.88e-05 2.8e-05 1.2e-05 ] [ 4e-07 -3.29e-05 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 -3.2043532416e-15 3.52478856576e-14 ] [ 8.8119714144e-15 1.0510278632448e-13 2.339177866368e-14 ] [ 3.2043532416e-16 1.890568412544e-14 -4.870616927232e-14 ] [ 2.48337376224e-14 -1.129534517664e-13 -2.066807840832e-14 ] [ -4.614268667904e-14 4.48609453824e-14 1.92261194496e-14 ] [ 6.408706483200001e-16 -5.271161082432e-14 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.678892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.992688406484816e-18 } }