{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6788209 -1.1680599 3.1771376 ] [ 2.9783538 1.6548436 -5.0195331 ] [ 0.8875839 -2.5489516 -0.101494 ] [ -2.5756805 4.3127205 4.9936996 ] [ 0.3885637 -2.2505526 -3.04981 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.689767596490415e-09 -1.871438263473986e-09 5.090335583784623e-09 ] [ 4.771848826830839e-09 2.651351727000507e-09 -8.042178580151749e-09 ] [ 1.422066173578485e-09 -4.083870661070753e-09 -1.626113139514752e-10 ] [ -4.126695079750455e-09 6.909739957144887e-09 8.000788750418313e-09 ] [ 6.22547675831545e-10 -3.605782759600654e-09 -4.886334279882048e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.243563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121852701469191e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3183356 1.1977165 3.1414619 ] [ 0.9169011 2.7233126 1.1738716 ] [ 1.4697709 0.2052304 1.0808053 ] [ 3.1225355 1.9240619 0.1474643 ] [ 2.7746363 1.7541245 2.6787143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.183356e-11 1.1977165e-10 3.1414619e-10 ] [ 9.169011000000001e-11 2.7233126e-10 1.1738716e-10 ] [ 1.4697709e-10 2.052304e-11 1.0808053e-10 ] [ 3.1225355e-10 1.9240619e-10 1.474643e-11 ] [ 2.7746363e-10 1.7541245e-10 2.6787143e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -4e-06 6.4e-06 ] [ -6.5e-06 3.7e-06 -9.6e-06 ] [ -3e-07 3.9e-06 -2.4e-06 ] [ 1.1e-06 -1.8e-06 -5e-07 ] [ 1.06e-05 -1.9e-06 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 -6.4087064832e-15 1.025393037312e-14 ] [ -1.04141480352e-14 5.928053496960001e-15 -1.538089555968e-14 ] [ -4.8065298624e-16 6.24848882112e-15 -3.84522388992e-15 ] [ 1.76239428288e-15 -2.88391791744e-15 -8.010883104e-16 ] [ 1.698307218048e-14 -3.04413557952e-15 9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }