{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9994626 1.26317 2.8359724 ] [ 1.0377661 0.1291429 0.0926715 ] [ 1.9500731 -0.4075982 -2.8480964 ] [ 2.6259867 -1.9270404 -3.77018 ] [ -1.517819 0.1865576 1.4884228 ] [ -1.5372997 0.0083497 0.7544029 ] [ -1.5592446 0.7474183 1.4468069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.601315611083982e-09 2.023821442095936e-09 4.543728676514066e-09 ] [ 1.662684583278795e-09 2.069097351223123e-10 1.484761107144672e-10 ] [ 3.124361529670981e-09 -6.530443067201626e-10 -4.563153465864645e-09 ] [ 4.207294497271743e-09 -3.087459076217081e-09 -6.040494252207744e-09 ] [ -2.431814116406035e-09 2.98898225152558e-10 2.384716212025674e-09 ] [ -2.463025638502853e-09 1.337769413069376e-11 1.20868668904372e-09 ] [ -2.498185244228648e-09 1.197496126218081e-09 2.318040189992123e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.380009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.066325705549359e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7541124 3.2494342 1.1302368 ] [ 1.2685727 2.3971216 2.6982832 ] [ 2.3568924 4.4629193 3.2340525 ] [ 4.6135409 2.4106951 2.347676 ] [ 3.0749157 2.2962208 4.1539558 ] [ 4.3577166 4.7508709 1.8927189 ] [ 4.5907705 4.058391 4.0893509 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7541124e-10 3.2494342e-10 1.1302368e-10 ] [ 1.2685727e-10 2.3971216e-10 2.6982832e-10 ] [ 2.3568924e-10 4.4629193e-10 3.2340525e-10 ] [ 4.6135409e-10 2.4106951e-10 2.347676e-10 ] [ 3.0749157e-10 2.2962208e-10 4.1539558e-10 ] [ 4.3577166e-10 4.7508709e-10 1.8927189e-10 ] [ 4.5907705e-10 4.058391e-10 4.0893509e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 1.45e-05 -6.8e-06 ] [ -4e-07 -3.4e-06 6.1e-06 ] [ -2.3e-06 -5.8e-06 -8.1e-06 ] [ -3.8e-06 -2.3e-06 -2e-07 ] [ -4.3e-06 -7.8e-06 7.7e-06 ] [ -2e-07 -4.2e-06 1e-06 ] [ 7.3e-06 9e-06 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 2.32315610016e-14 -1.089480102144e-14 ] [ -6.408706483200001e-16 -5.44740051072e-15 9.77327738688e-15 ] [ -3.68500622784e-15 -9.292624400640001e-15 -1.297763062848e-14 ] [ -6.08827115904e-15 -3.68500622784e-15 -3.2043532416e-16 ] [ -6.889359469440001e-15 -1.249697764224e-14 1.233675998016e-14 ] [ -3.2043532416e-16 -6.72914180736e-15 1.6021766208e-15 ] [ 1.169588933184e-14 1.44195895872e-14 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497168915979e-18 } }