{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3801314 0.0829428 -0.9225828 ] [ -2.3356066 0.2260395 0.6258716 ] [ -2.2270265 -3.7406346 2.3821664 ] [ 1.0889018 2.4718796 0.1012874 ] [ 0.8739005 -1.0956425 -4.1482367 ] [ 1.1049752 0.7126045 0.9964541 ] [ 2.8749869 1.3428107 0.96504 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.211214262711973e-09 1.328890150236902e-10 -1.478140592912202e-09 ] [ -3.742054289906178e-09 3.621552022773216e-10 1.002756845142689e-09 ] [ -3.568089792202051e-09 -5.99315730307556e-09 3.816651312935301e-09 ] [ 1.744613006307037e-09 3.960387704552455e-09 1.622803042616179e-10 ] [ 1.40014295000543e-09 -1.755412798254864e-09 -6.646207858284544e-09 ] [ 1.770365432003804e-09 1.141718269776874e-09 1.596495462720305e-09 ] [ 4.606236796286268e-09 2.151419909700083e-09 1.546164526136832e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.171983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.513649252417505e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0819408 0.9837485 2.9057449 ] [ 1.6949728 2.6299364 4.6615385 ] [ 2.3195554 3.3608335 2.4216724 ] [ 3.3109172 4.4322629 4.3737391 ] [ 3.9370442 1.7686786 1.5328032 ] [ 3.9690293 2.1250072 3.9438866 ] [ 4.6965933 3.899975 2.4400722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0819408e-10 9.837485e-11 2.9057449e-10 ] [ 1.6949728e-10 2.6299364e-10 4.6615385e-10 ] [ 2.3195554e-10 3.3608335e-10 2.4216724e-10 ] [ 3.3109172e-10 4.4322629e-10 4.3737391e-10 ] [ 3.9370442e-10 1.7686786e-10 1.5328032e-10 ] [ 3.9690293e-10 2.1250072e-10 3.9438866e-10 ] [ 4.6965933e-10 3.899975e-10 2.4400722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -8e-07 -8e-06 ] [ -2.35e-05 -5.5e-06 1.46e-05 ] [ 7.9e-06 1.01e-05 2.7e-06 ] [ 5e-06 8.8e-06 -1.75e-05 ] [ -7.1e-06 -2.9e-05 -1.57e-05 ] [ 2.72e-05 -9.7e-06 6.4e-06 ] [ -4e-06 2.59e-05 1.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 -1.28174129664e-15 -1.28174129664e-14 ] [ -3.76511505888e-14 -8.8119714144e-15 2.339177866368e-14 ] [ 1.265719530432e-14 1.618198387008e-14 4.32587687616e-15 ] [ 8.010883104e-15 1.409915426304e-14 -2.8038090864e-14 ] [ -1.137545400768e-14 -4.64631220032e-14 -2.515417294656e-14 ] [ 4.357920408576e-14 -1.554111322176e-14 1.025393037312e-14 ] [ -6.4087064832e-15 4.149637447872e-14 2.8038090864e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }