{ "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" [ [ -2.3267346 -1.6092074 -0.9727293 ] [ -2.0582966 -0.4501132 2.1379305 ] [ -3.0511242 1.1780555 -1.9791306 ] [ -0.0434186 2.6525101 1.0705992 ] [ 1.0907789 -1.7267246 -2.9485932 ] [ 3.6056291 -1.6175688 3.0675827 ] [ 2.7831661 1.5730484 -0.3756592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.72783977892644e-09 -2.578234474298354e-09 -1.558484142827149e-09 ] [ -3.297754691192129e-09 -7.211608457534745e-10 3.425342263995254e-09 ] [ -4.888439860397103e-09 1.887452980104854e-09 -3.170916776829877e-09 ] [ -6.956426582786689e-11 4.24978966865587e-09 1.715289008487183e-09 ] [ 1.747620452041941e-09 -2.766517784680232e-09 -4.724167089289859e-09 ] [ 5.776854647296145e-09 -2.591630913895511e-09 4.91480928431054e-09 ] [ 4.459123657223115e-09 2.520301369866847e-09 -6.018723876284314e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.62297 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.503075728145978e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7456445 1.6699828 2.5794752 ] [ 2.3645968 2.2299683 4.7953051 ] [ 2.0540028 3.8962821 1.908235 ] [ 2.6838674 4.4662244 4.1634191 ] [ 3.994276 1.3032768 2.0215692 ] [ 4.6242014 1.8731442 4.2767538 ] [ 4.543464 3.7615635 2.5346997 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7456445e-10 1.6699828e-10 2.5794752e-10 ] [ 2.3645968e-10 2.2299683e-10 4.7953051e-10 ] [ 2.0540028e-10 3.8962821e-10 1.908235e-10 ] [ 2.6838674e-10 4.4662244e-10 4.1634191e-10 ] [ 3.994276e-10 1.3032768e-10 2.0215692e-10 ] [ 4.6242014e-10 1.8731442e-10 4.2767538e-10 ] [ 4.543464e-10 3.7615635e-10 2.5346997e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 -2.22e-05 -1.53e-05 ] [ -1.48e-05 2.2e-05 -1.44e-05 ] [ -1.19e-05 -5e-07 1.2e-05 ] [ -4e-06 -1.97e-05 2.19e-05 ] [ -1.7e-05 2.02e-05 2.06e-05 ] [ 9e-06 1.16e-05 -3.3e-06 ] [ 3.81e-05 -1.14e-05 -2.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 -3.556832098176e-14 -2.451330229824e-14 ] [ -2.371221398784e-14 3.52478856576e-14 -2.307134333952e-14 ] [ -1.906590178752e-14 -8.010883104e-16 1.92261194496e-14 ] [ -6.4087064832e-15 -3.156287942976e-14 3.508766799552e-14 ] [ -2.72370025536e-14 3.236396774016e-14 3.300483838848e-14 ] [ 1.44195895872e-14 1.858524880128e-14 -5.28718284864e-15 ] [ 6.104292925248e-14 -1.826481347712e-14 -3.44467973472e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.320543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93527456749611e-18 } }