{ "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" [ [ 0.635409 0.2945373 0.4894103 ] [ 0.6913641 0.4672635 2.355287 ] [ 2.952385 0.4157679 2.192681 ] [ 2.385934 1.774442 0.4759126 ] [ 2.093707 2.943435 1.550224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.35409e-11 2.945373e-11 4.894103e-11 ] [ 6.913641e-11 4.672635e-11 2.355287e-10 ] [ 2.952385e-10 4.157679e-11 2.192681e-10 ] [ 2.385934000000001e-10 1.774442e-10 4.759126e-11 ] [ 2.093707e-10 2.943435e-10 1.550224e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6348165 -9.32216 -227.9055085 ] [ 1.6183321 19.0706704 230.1633014 ] [ 4.3039428 1.6992552 -3.6243345 ] [ 154.7877784 -654.0168174 -586.843468 ] [ -163.3448699 642.5690517 588.2100096 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.22144143117766e-09 -1.493574693040944e-08 -3.651448804785884e-07 ] [ 2.592853876672151e-09 3.055458250959543e-08 3.687622635073794e-07 ] [ 6.895676588232534e-09 2.722506976642996e-09 -5.806824049700072e-09 ] [ 2.479973617812499e-07 -1.047850463081325e-06 -9.402268922451267e-07 ] [ -2.617073338375499e-07 1.029509120365278e-06 9.424163332660356e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 189.53886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.036747327269972e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3347084 0.2331199 0.0714278 ] [ 0.9150884 0.8764541 2.5101005 ] [ 3.3454826 0.0108741 2.3056317 ] [ 2.5884492 1.4817292 0.3153189 ] [ 1.5750704 3.2932684 1.861036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.347084e-11 2.331199e-11 7.14278e-12 ] [ 9.150884e-11 8.764541e-11 2.5101005e-10 ] [ 3.3454826e-10 1.08741e-12 2.3056317e-10 ] [ 2.5884492e-10 1.4817292e-10 3.153189000000001e-11 ] [ 1.5750704e-10 3.2932684e-10 1.861036e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.79e-05 -1.81e-05 -3.21e-05 ] [ -1.35e-05 -3.5e-06 5.23e-05 ] [ -1.08e-05 2.19e-05 -1e-05 ] [ 3.28e-05 -3e-07 -1.96e-05 ] [ 9.4e-06 0.0 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.86789617486e-14 -2.899939707539999e-14 -5.14298699514e-14 ] [ -2.162938455899999e-14 -5.607618218999999e-15 8.379383795819998e-14 ] [ -1.73035076472e-14 3.50876682846e-14 -1.602176634e-14 ] [ 5.255139359519999e-14 -4.806529901999999e-16 -3.140266202639999e-14 ] [ 1.50604603596e-14 0.0 1.50604603596e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.289176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609813717431358e-18 } }