{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.232723 -3.8376006 -6.9190024 ] [ -0.9318672 -5.2572888 6.8547437 ] [ -2.6405169 -2.3087107 1.3458106 ] [ -4.9523591 8.4100197 0.7006037 ] [ 8.7574662 2.9935804 -1.9821556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.728633497224384e-10 -6.148513961288052e-09 -1.108546388453909e-08 ] [ -1.493015841530358e-09 -8.423105204153688e-09 1.098251009771609e-08 ] [ -4.230574444007292e-09 -3.698962307730802e-09 2.156226279344821e-09 ] [ -7.93455396782613e-09 1.347433694380743e-08 1.122490868585977e-09 ] [ 1.403100760308622e-08 4.796244529365112e-09 -3.175763361107797e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.62807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.023239851982585e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0659456 2.261633 2.0760738 ] [ 2.3730832 2.1927111 4.636541 ] [ 0.023869 2.1635992 3.6179742 ] [ 1.4196315 4.3076489 3.5082619 ] [ 3.8819049 3.6777247 3.195945 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0659456e-10 2.261633e-10 2.0760738e-10 ] [ 2.3730832e-10 2.1927111e-10 4.636541000000001e-10 ] [ 2.3869e-12 2.1635992e-10 3.6179742e-10 ] [ 1.4196315e-10 4.3076489e-10 3.5082619e-10 ] [ 3.8819049e-10 3.677724700000001e-10 3.195945e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.09e-05 5.5e-06 4.16e-05 ] [ -2.3e-06 -4.73e-05 1.23e-05 ] [ 8.2e-06 -7e-07 -1.52e-05 ] [ -2.6e-05 2.44e-05 -2.06e-05 ] [ 4.11e-05 1.82e-05 -1.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.348549137472e-14 8.8119714144e-15 6.665054742528e-14 ] [ -3.68500622784e-15 -7.578295416384e-14 1.970677243584e-14 ] [ 1.313784829056e-14 -1.12152363456e-15 -2.435308463616e-14 ] [ -4.16565921408e-14 3.909310954752e-14 -3.300483838848e-14 ] [ 6.584945911488e-14 2.915961449856e-14 -2.899939683648e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }