{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5675523 -3.7798926 -4.4903119 ] [ 1.9453408 0.9083721 -0.1805909 ] [ -0.8393034 -1.5304024 2.0686572 ] [ -2.9828294 -1.8804127 -2.7003506 ] [ 1.1979786 2.7675805 3.1876772 ] [ -0.0283932 -0.1708301 0.2782821 ] [ 4.2747589 3.6855852 1.836637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.715848888541268e-09 -6.056055552854926e-09 -7.194272746280027e-09 ] [ 3.116779549248369e-09 1.455372541607e-09 -2.893385179092307e-10 ] [ -1.344712285237951e-09 -2.45197494569621e-09 3.31435420228959e-09 ] [ -4.779019528514892e-09 -3.012753265395404e-09 -4.326438599283253e-09 ] [ 1.919373305138715e-09 4.434152773281975e-09 5.107221884497206e-09 ] [ -4.549092122969856e-11 -2.736999923489261e-10 4.458570746071276e-10 ] [ 6.848918769136725e-09 5.904958441406492e-09 2.94261686229625e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.099619 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899878640718748e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8075202 2.1888811 0.8172776 ] [ 1.966379 1.3651026 2.9282475 ] [ 2.7271631 2.8263988 4.4988607 ] [ 4.2470887 0.7639686 2.1362156 ] [ 5.2932488 2.1500492 3.6077208 ] [ 3.5142799 4.306378 1.245328 ] [ 4.2451143 4.2382336 3.4015086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8075202e-10 2.1888811e-10 8.172776000000001e-11 ] [ 1.966379e-10 1.3651026e-10 2.9282475e-10 ] [ 2.7271631e-10 2.826398800000001e-10 4.4988607e-10 ] [ 4.2470887e-10 7.639686e-11 2.1362156e-10 ] [ 5.2932488e-10 2.1500492e-10 3.6077208e-10 ] [ 3.5142799e-10 4.306378e-10 1.245328e-10 ] [ 4.2451143e-10 4.2382336e-10 3.4015086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 2.13e-05 -3.35e-05 ] [ -2.27e-05 -2.8e-06 6.65e-05 ] [ -2.25e-05 -3.1e-06 -2.69e-05 ] [ 4.02e-05 -2.64e-05 2.22e-05 ] [ 1.76e-05 -1.43e-05 -1.84e-05 ] [ 1.81e-05 4.45e-05 5.6e-06 ] [ -2.52e-05 -1.93e-05 -1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 3.412636202304e-14 -5.36729167968e-14 ] [ -3.636940929216e-14 -4.48609453824e-15 1.065447452832e-13 ] [ -3.604897396800001e-14 -4.96674752448e-15 -4.309855109952001e-14 ] [ 6.440750015616e-14 -4.229746278912e-14 3.556832098176e-14 ] [ 2.819830852608e-14 -2.291112567744e-14 -2.948004982272e-14 ] [ 2.899939683648e-14 7.129685962560001e-14 8.972189076479999e-15 ] [ -4.037485084416e-14 -3.092200878144e-14 -2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.166475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.551460801054768e-18 } }