{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0638929 0.9495388 -0.3978714 ] [ -0.7796521 -0.8703179 -0.5461425 ] [ 0.5799151 2.5630476 -0.4136255 ] [ 2.0685872 2.2415109 1.6573806 ] [ -0.7299387 -2.7582095 2.0807044 ] [ 0.9249814 -2.1255698 -2.3804457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.306720952215113e-09 1.521328865902487e-09 -6.374602551649651e-10 ] [ -1.249140366977624e-09 -1.394402992043752e-09 -8.750167451252639e-10 ] [ 9.291264152688941e-10 4.106454942717551e-09 -6.627011058667104e-10 ] [ 3.314242049926134e-09 3.591296359248367e-09 2.655416449087477e-09 ] [ -1.169490719757145e-09 -4.419138776168458e-09 3.333655944475692e-09 ] [ 1.481983573754853e-09 -3.405538239438532e-09 -3.81389444762389e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.700777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.874671135459436e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0157648 0.3669044 1.4482158 ] [ -0.0700313 2.5193541 2.4747725 ] [ 2.1221765 0.4693575 0.0301043 ] [ 2.3571234 0.1512257 2.6331558 ] [ 2.959894 2.6667862 0.4347672 ] [ 2.2995028 2.5637473 2.7219127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57648e-12 3.669044e-11 1.4482158e-10 ] [ -7.003130000000001e-12 2.5193541e-10 2.4747725e-10 ] [ 2.1221765e-10 4.693575e-11 3.01043e-12 ] [ 2.3571234e-10 1.512257e-11 2.6331558e-10 ] [ 2.959894e-10 2.6667862e-10 4.347672e-11 ] [ 2.2995028e-10 2.5637473e-10 2.7219127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.08e-05 8.1e-06 1.98e-05 ] [ -1.38e-05 7.8e-06 -2.34e-05 ] [ -3.23e-05 1.14e-05 -1.03e-05 ] [ 7.6e-06 2.7e-06 9.8e-06 ] [ 5.8e-06 -3e-07 1.78e-05 ] [ -8.1e-06 -2.98e-05 -1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.536880612864e-14 1.297763062848e-14 3.172309709184e-14 ] [ -2.211003736704e-14 1.249697764224e-14 -3.749093292672001e-14 ] [ -5.175030485184e-14 1.826481347712e-14 -1.650241919424e-14 ] [ 1.217654231808e-14 4.32587687616e-15 1.570133088384e-14 ] [ 9.292624400640001e-15 -4.8065298624e-16 2.851874385024e-14 ] [ -1.297763062848e-14 -4.774486329984001e-14 -2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.124626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423232217554382e-18 } }