{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.4580124 -38.8691921 15.1992356 ] [ -12.940707 14.4946486 4.9757831 ] [ 42.0595829 -24.2094844 -39.5183307 ] [ 29.9249105 -2.0439761 47.720865 ] [ -21.585774 50.628004 -28.377553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.00143517289165e-08 -6.227531085200406e-08 2.435185993235106e-08 ] [ -2.07332982120229e-08 2.322298711363145e-08 7.97208335299175e-09 ] [ 6.738688040297947e-08 -3.878786990730232e-08 -6.33153455405829e-08 ] [ 4.794499198263244e-08 -3.274810720893963e-09 7.6457254227353e-08 ] [ -3.45842224446725e-08 8.111500436656887e-08 -4.54658519721129e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 50.090409 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.02536822261099e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5086939 0.4485292 2.811029 ] [ -0.2303067 2.1973216 1.422606 ] [ 3.2231702 1.1298386 0.2321372 ] [ 2.6431199 -0.211125 2.0753626 ] [ 1.4473115 2.6183631 -0.1712708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.086939e-11 4.485292e-11 2.811029e-10 ] [ -2.303067e-11 2.1973216e-10 1.422606e-10 ] [ 3.2231702e-10 1.1298386e-10 2.321372e-11 ] [ 2.6431199e-10 -2.11125e-11 2.0753626e-10 ] [ 1.4473115e-10 2.6183631e-10 -1.712708e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 -1.76e-05 3.08e-05 ] [ -2.81e-05 2.22e-05 -1.55e-05 ] [ 4.57e-05 -4.5e-06 -1.72e-05 ] [ -1.42e-05 -9e-07 -4.8e-06 ] [ -9.8e-06 8e-07 6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 -2.819830852608e-14 4.934703992064001e-14 ] [ -4.502116304448e-14 3.556832098176e-14 -2.48337376224e-14 ] [ 7.321947157056e-14 -7.2097947936e-15 -2.755743787776e-14 ] [ -2.275090801536e-14 -1.44195895872e-15 -7.69044777984e-15 ] [ -1.570133088384e-14 1.28174129664e-15 1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }