{ "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" [ [ -13.3248015 -15.8078029 -4.0269195 ] [ -13.2860696 -2.7959119 16.328174 ] [ -12.9340458 10.4100084 -13.3139652 ] [ -0.3707834 17.6703041 11.8201206 ] [ 8.5957398 -12.0801382 -16.2933691 ] [ 14.4482147 -9.513973 12.5670744 ] [ 16.8717458 12.1175137 -7.0811152 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.134868544010077e-08 -2.532689223259444e-08 -6.451836276743626e-09 ] [ -2.128663009544161e-08 -4.479544679996508e-09 2.616061864315442e-08 ] [ -2.072262579311643e-08 1.667867208081162e-08 -2.13313237735848e-08 ] [ -5.940604948607347e-10 2.831094811144639e-08 1.893792088035647e-08 ] [ 1.377189334604007e-08 -1.935451500007299e-08 -2.610485504608513e-08 ] [ 2.314859180463889e-08 -1.524306511152244e-08 2.013467279553419e-08 ] [ 2.703151667284059e-08 1.941439715236371e-08 -1.134519722263152e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 159.94322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.56257287739471e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.0108226 -3.6982414 1.4908705 ] [ -2.1363148 1.6036479 9.9687368 ] [ -0.7841797 6.1453464 -1.1348705 ] [ 3.2123424 9.7267387 7.6433853 ] [ 6.648226 -1.6197625 -3.0589427 ] [ 7.5592922 -0.3253632 7.1181788 ] [ 9.5215095 7.3680761 0.2520988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.0108226e-10 -3.6982414e-10 1.4908705e-10 ] [ -2.1363148e-10 1.6036479e-10 9.968736800000002e-10 ] [ -7.841797e-11 6.1453464e-10 -1.1348705e-10 ] [ 3.2123424e-10 9.7267387e-10 7.6433853e-10 ] [ 6.648226000000001e-10 -1.6197625e-10 -3.0589427e-10 ] [ 7.5592922e-10 -3.253632e-11 7.1181788e-10 ] [ 9.521509500000002e-10 7.3680761e-10 2.520988e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }