{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0780832 -0.2979949 -1.2895283 ] [ -0.8682962 1.1904926 -0.4070107 ] [ 0.7138309 -1.340831 0.0058364 ] [ -0.0685845 -0.3281414 -0.8724597 ] [ 0.6564807 -1.3326461 0.5953374 ] [ -0.601252 0.2355695 0.0147673 ] [ 1.2459044 1.8735513 1.9530576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.727279698317251e-09 -4.774404618976339e-10 -2.066052094119969e-09 ] [ -1.391163871569481e-09 1.907379410955406e-09 -6.521030279554426e-10 ] [ 1.143683179184623e-09 -2.148248080643885e-09 9.350943629637121e-12 ] [ -1.098844824492576e-10 -5.257404793965812e-10 -1.397834533930182e-09 ] [ 1.051798029546419e-09 -2.135134425220299e-09 9.53835663767858e-10 ] [ -9.633118976092415e-10 3.774239454735456e-10 2.365982281233984e-11 ] [ 1.996158901431851e-09 3.001760090729447e-09 3.129143225795758e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.502206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.765468499042549e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7962665 2.1596541 3.4722356 ] [ 2.1393133 4.5165994 3.2023575 ] [ 2.9411372 2.9129037 1.5056143 ] [ 4.9339155 2.148046 2.596278 ] [ 3.8175993 1.9155872 4.658292 ] [ 4.5169311 4.507812 2.5385259 ] [ 3.875814 4.2644885 4.8353608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7962665e-10 2.1596541e-10 3.4722356e-10 ] [ 2.1393133e-10 4.5165994e-10 3.2023575e-10 ] [ 2.9411372e-10 2.9129037e-10 1.5056143e-10 ] [ 4.933915500000001e-10 2.148046e-10 2.596278e-10 ] [ 3.8175993e-10 1.9155872e-10 4.658292000000001e-10 ] [ 4.5169311e-10 4.507812e-10 2.5385259e-10 ] [ 3.875814e-10 4.2644885e-10 4.835360800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 2.95e-05 -3.5e-06 ] [ -3.56e-05 6.8e-05 3.16e-05 ] [ 3.16e-05 -5.22e-05 -1.73e-05 ] [ 2.32e-05 -7.8e-06 -3.09e-05 ] [ 2.36e-05 -4.35e-05 1.39e-05 ] [ -1.29e-05 -1.06e-05 2.6e-06 ] [ -2.23e-05 1.66e-05 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 4.72642103136e-14 -5.6076181728e-15 ] [ -5.703748770048e-14 1.089480102144e-13 5.062878121728e-14 ] [ 5.062878121728e-14 -8.363361960576001e-14 -2.771765553984e-14 ] [ 3.717049760256e-14 -1.249697764224e-14 -4.950725758272e-14 ] [ 3.781136825088e-14 -6.969468300480001e-14 2.227025502912e-14 ] [ -2.066807840832e-14 -1.698307218048e-14 4.16565921408e-15 ] [ -3.572853864384e-14 2.659613190528e-14 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }