{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.051773 2.11113 1.612774 ] [ 4.096623 0.6333142 0.1280934 ] [ 4.940584 2.852779 0.2569481 ] [ 3.858102 4.269978 1.799879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.051773e-10 2.11113e-10 1.612774e-10 ] [ 4.096623e-10 6.333142000000001e-11 1.280934e-11 ] [ 4.940584000000001e-10 2.852779e-10 2.569481e-11 ] [ 3.858102e-10 4.269978e-10 1.799879e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7950287 -0.5577926 0.4565661 ] [ 0.1794265 -0.0394593 -0.16584 ] [ 0.4245073 0.0202022 -0.3681313 ] [ 0.1910949 0.5770497 0.0774052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.273776396005017e-09 -8.936822629752461e-10 7.314995312698348e-10 ] [ 2.874729434519712e-10 -6.322076793313344e-11 -2.65704970793472e-10 ] [ 6.801356714189318e-10 3.236749252872576e-11 -5.89811362244711e-10 ] [ 3.061677811341139e-10 9.245355383796538e-10 1.240168017683482e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.219734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.637381888559487e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9072616 2.0409414 1.7230558 ] [ 4.097176 0.7742649 0.1717959 ] [ 5.0662797 2.892659 0.1757921 ] [ 3.8763647 4.1593359 1.7270507 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9072616e-10 2.0409414e-10 1.7230558e-10 ] [ 4.097176e-10 7.742649e-11 1.717959e-11 ] [ 5.0662797e-10 2.892659e-10 1.757921e-11 ] [ 3.8763647e-10 4.1593359e-10 1.7270507e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 2e-07 -2.7e-06 ] [ -1.4e-06 -3.1e-06 3e-07 ] [ -8e-07 4e-07 6e-07 ] [ -7e-07 2.5e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.646312200320001e-15 3.2043532416e-16 -4.32587687616e-15 ] [ -2.24304726912e-15 -4.96674752448e-15 4.8065298624e-16 ] [ -1.28174129664e-15 6.408706483200001e-16 9.6130597248e-16 ] [ -1.12152363456e-15 4.005441552e-15 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.314569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.652576130542844e-18 } }