{ "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" [ [ 0.5308739 0.2525778 2.81745 ] [ 0.4737551 1.568741 0.832487 ] [ 2.312512 2.941662 0.559243 ] [ 2.76942 1.516894 1.016982 ] [ 2.535548 1.814472 2.698768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.308739e-11 2.525778e-11 2.81745e-10 ] [ 4.737551e-11 1.568741e-10 8.32487e-11 ] [ 2.312512e-10 2.941662e-10 5.592430000000001e-11 ] [ 2.76942e-10 1.516894e-10 1.016982e-10 ] [ 2.535548e-10 1.814472e-10 2.698768e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8860216 -5.401613 6.7875179 ] [ -33.2526945 -6.433991 -13.916965 ] [ -4.3021464 48.7156616 -25.3055961 ] [ 31.8176711 -36.8569326 -16.229117 ] [ 12.6231914 -0.023125 48.6641601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.103262281784381e-08 -8.654338063209352e-09 1.087480249264151e-08 ] [ -5.327668970650474e-08 -1.030838995863761e-08 -2.229743595549187e-08 ] [ -6.892798381338885e-09 7.805109408232432e-08 -4.054403444682765e-08 ] [ 5.097752876472381e-08 -5.905131572612136e-08 -2.600191183362783e-08 ] [ 2.022458214096362e-08 -3.7050334356e-11 7.796857958308819e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.690526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.276293675405454e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.42131 0.7369075 2.8207649 ] [ -0.1067498 1.8328897 0.8077889 ] [ 1.8958027 2.6330708 -0.1311454 ] [ 3.6615095 2.0317403 1.3016048 ] [ 2.7502366 0.8597385 3.1259168 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.2131e-11 7.369075000000001e-11 2.8207649e-10 ] [ -1.067498e-11 1.8328897e-10 8.077889000000001e-11 ] [ 1.8958027e-10 2.6330708e-10 -1.311454e-11 ] [ 3.6615095e-10 2.0317403e-10 1.3016048e-10 ] [ 2.7502366e-10 8.597385e-11 3.1259168e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.25e-05 -9e-06 1.21e-05 ] [ -0.0001232 1.55e-05 -6.07e-05 ] [ -4.6e-06 3.15e-05 -3.85e-05 ] [ 5.35e-05 -1.85e-05 2.32e-05 ] [ 6.18e-05 -1.93e-05 6.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.002720776e-14 -1.44195895872e-14 1.938633711168e-14 ] [ -1.9738815968256e-13 2.48337376224e-14 -9.725212088256e-14 ] [ -7.370012455680001e-15 5.04685635552e-14 -6.16837999008e-14 ] [ 8.57164492128e-14 -2.96402674848e-14 3.717049760256e-14 ] [ 9.901451516544e-14 -3.092200878144e-14 1.025393037312e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }