{ "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" [ [ -4.3361285 -0.3537355 -1.9837077 ] [ 1.4715732 -0.002197 -0.0928514 ] [ -1.1501544 1.0440565 -0.1780001 ] [ 4.4751032 -6.6811522 -5.6628643 ] [ -2.756411 -3.1605712 5.1054197 ] [ -1.4802919 4.6052118 -2.5746401 ] [ 3.7763093 4.5483876 5.3866439 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.947243764721468e-09 -5.667467527163069e-10 -3.178250125625882e-09 ] [ 2.357720196260609e-09 -3.519982064898e-12 -1.487643435141876e-10 ] [ -1.842750505172289e-09 1.672762928875821e-09 -2.851876010696634e-10 ] [ 7.169905781778628e-09 -1.070438594303769e-08 -9.072908862972764e-09 ] [ -4.416257297900573e-09 -5.063793326733341e-09 8.179784150103288e-09 ] [ -2.371689093679465e-09 7.378362740581081e-09 -4.125028209179422e-09 ] [ 6.050314523216895e-09 7.287320335095337e-09 8.630354992258633e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.908004 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907872576637854e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0744636 3.0337481 1.9555096 ] [ 0.2866065 2.6744324 0.549606 ] [ 2.7097338 4.2672613 4.094919 ] [ 4.451752 2.2262096 2.4011158 ] [ 4.13571 2.3168418 4.939312 ] [ 3.9573709 4.8052343 1.7573588 ] [ 5.4008844 4.3019255 3.8484529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0744636e-10 3.0337481e-10 1.9555096e-10 ] [ 2.866065e-11 2.6744324e-10 5.496060000000001e-11 ] [ 2.7097338e-10 4.267261300000001e-10 4.094919e-10 ] [ 4.451752e-10 2.2262096e-10 2.4011158e-10 ] [ 4.135710000000001e-10 2.3168418e-10 4.939312e-10 ] [ 3.9573709e-10 4.805234300000001e-10 1.7573588e-10 ] [ 5.4008844e-10 4.3019255e-10 3.8484529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -1.92e-05 -2.1e-05 ] [ -5.2e-06 1.13e-05 4.2e-06 ] [ 1.86e-05 4.6e-06 1e-07 ] [ 1.6e-06 1.52e-05 -1.5e-06 ] [ -5e-07 2.8e-06 3.3e-06 ] [ -2.14e-05 -1.37e-05 -1.31e-05 ] [ 7.2e-06 -1.1e-06 2.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 -3.076179137279999e-14 -3.364570931399999e-14 ] [ -8.331318496799998e-15 1.81045959642e-14 6.729141862799999e-15 ] [ 2.98004853924e-14 7.370012516399999e-15 1.602176634e-16 ] [ 2.5634826144e-15 2.43530848368e-14 -2.403264951e-15 ] [ -8.010883169999999e-16 4.486094575199999e-15 5.2871828922e-15 ] [ -3.42865799676e-14 -2.19498198858e-14 -2.09885139054e-14 ] [ 1.15356717648e-14 -1.7623942974e-15 4.486094575199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.805309 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.53228967729499e-18 } }