{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5423061 -0.4006332 -0.2913289 ] [ -1.7861359 -0.4160561 0.9196002 ] [ -0.1531962 0.2601468 0.2846501 ] [ 0.0301018 0.4389544 -0.1366988 ] [ 2.4802459 -1.5222399 -1.4964182 ] [ -0.1189897 2.1572129 1.0466856 ] [ 0.0902802 -0.5173848 -0.32649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.688701547372269e-10 -6.418851465562905e-10 -4.667603525433811e-10 ] [ -2.861705180551567e-09 -6.665953563612269e-10 1.473361940923004e-09 ] [ -2.45447370035401e-10 4.168011209359335e-10 4.560597353283821e-10 ] [ 4.822840020399744e-11 7.032824772772915e-10 -2.190156214514151e-10 ] [ 3.973791994815054e-09 -2.43889717902893e-09 -2.397526254979618e-09 ] [ -1.906425154560058e-10 3.456236074468169e-09 1.676975197648021e-09 ] [ 1.446448257611482e-10 -8.289418305172838e-10 -5.23094644924992e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.721404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.800587890135161e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7308766 2.9018681 3.0862483 ] [ 2.8618925 0.6613916 5.1631896 ] [ 1.7148414 0.5457351 3.108196 ] [ 3.8182122 0.625932 2.0491901 ] [ 4.9133407 1.2686793 4.0822363 ] [ 3.3316266 2.9933327 4.8680844 ] [ 4.056317 2.9664636 2.5084484 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7308766e-10 2.9018681e-10 3.0862483e-10 ] [ 2.8618925e-10 6.613916e-11 5.163189600000001e-10 ] [ 1.7148414e-10 5.457351e-11 3.108196e-10 ] [ 3.8182122e-10 6.259320000000001e-11 2.0491901e-10 ] [ 4.9133407e-10 1.2686793e-10 4.0822363e-10 ] [ 3.3316266e-10 2.9933327e-10 4.8680844e-10 ] [ 4.056317e-10 2.9664636e-10 2.5084484e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.37e-05 1.21e-05 1.07e-05 ] [ 2.6e-06 -3.4e-06 -2.91e-05 ] [ -1.78e-05 -4.7e-06 2.4e-06 ] [ 1.69e-05 -7.9e-06 1.34e-05 ] [ 7.4e-06 2e-06 7.5e-06 ] [ 1.02e-05 6e-06 -1.24e-05 ] [ -5.6e-06 -4.1e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.194981970496e-14 1.938633711168e-14 1.714328984256e-14 ] [ 4.16565921408e-15 -5.44740051072e-15 -4.662333966527999e-14 ] [ -2.851874385024e-14 -7.53023011776e-15 3.84522388992e-15 ] [ 2.707678489152e-14 -1.265719530432e-14 2.146916671872e-14 ] [ 1.185610699392e-14 3.2043532416e-15 1.2016324656e-14 ] [ 1.634220153216e-14 9.6130597248e-15 -1.986699009792e-14 ] [ -8.972189076479999e-15 -6.568924145279999e-15 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }