{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9398812 2.717033 1.670565 ] [ 2.278193 2.647912 4.038221 ] [ 1.856764 5.001969 2.684043 ] [ 3.35912 1.891848 2.112837 ] [ 5.060666 2.631323 3.812603 ] [ 4.070835 4.158298 1.920429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.398812e-11 2.717033e-10 1.670565e-10 ] [ 2.278193e-10 2.647912e-10 4.038221e-10 ] [ 1.856764e-10 5.001969e-10 2.684043e-10 ] [ 3.35912e-10 1.891848e-10 2.112837e-10 ] [ 5.060666e-10 2.631323e-10 3.812603e-10 ] [ 4.070835e-10 4.158298e-10 1.920429e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3808321 0.836227 1.2334681 ] [ -0.0677002 0.7880225 -0.8267886 ] [ 0.4763388 -2.0563713 -0.2144774 ] [ -0.1241484 0.1399402 -0.0670268 ] [ -1.3526701 0.4428303 -0.859548 ] [ -0.3126523 -0.1506488 0.7343728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.212336907870167e-09 1.339783349081722e-09 1.976233752322597e-09 ] [ -1.084676776634842e-10 1.262551226164368e-09 -1.324661365263963e-09 ] [ 7.631788889399271e-10 -3.294670020544103e-09 -3.4363067596997e-10 ] [ -1.989076639897267e-10 2.242089167500761e-10 -1.073887719270374e-10 ] [ -2.167216409875198e-09 7.094923536418502e-10 -1.377147710055398e-09 ] [ -5.009242054993478e-10 -2.413659853115751e-10 1.176594931111434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.990524930490679 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.597878989951712e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5662966 3.0494862 1.7370212 ] [ 2.0978524 2.4441249 3.9659462 ] [ 2.4108227 4.6777566 3.2378969 ] [ 3.4443299 1.6717041 2.1750023 ] [ 4.2888564 3.2999757 3.6758781 ] [ 3.7573012 3.9053356 1.4469533 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5662966e-10 3.0494862e-10 1.7370212e-10 ] [ 2.0978524e-10 2.4441249e-10 3.9659462e-10 ] [ 2.4108227e-10 4.6777566e-10 3.2378969e-10 ] [ 3.4443299e-10 1.6717041e-10 2.1750023e-10 ] [ 4.2888564e-10 3.2999757e-10 3.6758781e-10 ] [ 3.7573012e-10 3.9053356e-10 1.4469533e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 -3.1e-06 2.1e-06 ] [ -2.7e-06 -3e-07 9e-07 ] [ 2e-07 4.1e-06 1.7e-06 ] [ 1.1e-06 0.0 4e-07 ] [ -2.1e-06 -3.3e-06 -1.8e-06 ] [ 3e-07 2.7e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965186560001e-15 -4.96674752448e-15 3.36457090368e-15 ] [ -4.32587687616e-15 -4.8065298624e-16 1.44195895872e-15 ] [ 3.2043532416e-16 6.568924145279999e-15 2.72370025536e-15 ] [ 1.76239428288e-15 0.0 6.408706483200001e-16 ] [ -3.36457090368e-15 -5.28718284864e-15 -2.88391791744e-15 ] [ 4.8065298624e-16 4.32587687616e-15 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }