{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7349112 -2.9922095 -1.6161114 ] [ -0.1196628 -2.2216018 -0.552411 ] [ 1.6488583 -2.5894876 0.5853059 ] [ -1.1750879 2.2140424 -3.8864527 ] [ 6.3925857 -0.6884939 -0.4797662 ] [ -2.5352855 6.4991923 -1.553555 ] [ 0.5235034 -0.2214419 7.5029904 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.5861640887049e-09 -4.794048144932823e-09 -2.589295923021027e-09 ] [ -1.917209421190152e-10 -3.559398494012341e-09 -8.850599965645739e-10 ] [ 2.641762241036962e-09 -4.148816526752738e-09 9.377634367223406e-10 ] [ -1.882698376276129e-09 3.547286999965281e-09 -6.226783705086211e-09 ] [ 1.024205143938253e-08 -1.103088839231533e-09 -7.686701954229708e-10 ] [ -4.061975188619006e-09 1.041285404293272e-08 -2.48906952063387e-09 ] [ 8.387449152995554e-10 -3.547890379685645e-10 1.202111590400631e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.03681606491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409163534896487e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9444174 2.2821792 2.822374 ] [ 3.5485951 1.7093957 0.9852541 ] [ 4.3329043 1.4780884 3.7290849 ] [ 3.4584794 4.0609635 0.5632071 ] [ 5.1172794 3.3228041 2.3003068 ] [ 3.0317214 4.5451695 2.8472417 ] [ 3.1697669 3.2501497 4.8386566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9444174e-10 2.2821792e-10 2.822374e-10 ] [ 3.5485951e-10 1.7093957e-10 9.852541000000001e-11 ] [ 4.3329043e-10 1.4780884e-10 3.729084900000001e-10 ] [ 3.4584794e-10 4.0609635e-10 5.632071e-11 ] [ 5.117279400000001e-10 3.3228041e-10 2.3003068e-10 ] [ 3.0317214e-10 4.5451695e-10 2.8472417e-10 ] [ 3.1697669e-10 3.2501497e-10 4.8386566e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 3.5e-05 3.17e-05 ] [ 5.1e-06 6.18e-05 5.44e-05 ] [ -1.68e-05 1.7e-05 -2.41e-05 ] [ 5.69e-05 -3.85e-05 2.25e-05 ] [ -0.0001084 2.86e-05 4.99e-05 ] [ -1.04e-05 -5.88e-05 -5.3e-05 ] [ 8.01e-05 -4.52e-05 -8.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.0414148121e-14 5.607618218999999e-14 5.078899929779999e-14 ] [ 8.1711008334e-15 9.901451598119999e-14 8.71584088896e-14 ] [ -2.691656745119999e-14 2.723700277799999e-14 -3.86124568794e-14 ] [ 9.116385047459999e-14 -6.168380040899999e-14 3.6048974265e-14 ] [ -1.736759471256e-13 4.58222517324e-14 7.994861403659999e-14 ] [ -1.66626369936e-14 -9.420798607919999e-14 -8.491536160199999e-14 ] [ 1.283343483834e-13 -7.24183838568e-14 -1.30577395671e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }