{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1058699 0.0664315 -0.458825 ] [ 1.1876332 0.6870048 -0.0515016 ] [ -0.4835348 0.165922 -0.2690718 ] [ -4.6219366 -0.8536126 0.6034725 ] [ 2.1968708 -1.6367158 0.0357136 ] [ 2.4614168 1.8264107 -1.1376292 ] [ -0.8463193 -0.2554406 1.2778414 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.696222800239166e-10 1.06434997061571e-10 -7.351186940950498e-10 ] [ 1.902798162802649e-09 1.100703038005843e-09 -8.251466013361439e-11 ] [ -7.747081582858632e-10 2.65836351466548e-10 -4.311005508283212e-10 ] [ -7.405158824349403e-09 -1.367638162207988e-09 9.668695387615648e-10 ] [ 3.519775063676887e-09 -2.622307811258617e-09 5.721949543602239e-11 ] [ 3.943624483495051e-09 2.926232547627583e-09 -1.822682922396112e-09 ] [ -1.355953007363236e-09 -4.092609606949404e-10 2.047327633037847e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.342429005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.778563452984141e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3333751 1.4360223 3.8069587 ] [ 2.5500264 5.0131134 2.1120076 ] [ 2.3311297 2.9120916 1.0052534 ] [ 1.0873681 3.3345658 3.0185148 ] [ 3.9910823 2.0822335 2.3563979 ] [ 4.2011008 4.0981654 3.4183464 ] [ 2.5522445 3.5370451 4.9137162 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3333751e-10 1.4360223e-10 3.8069587e-10 ] [ 2.5500264e-10 5.0131134e-10 2.1120076e-10 ] [ 2.3311297e-10 2.9120916e-10 1.0052534e-10 ] [ 1.0873681e-10 3.3345658e-10 3.0185148e-10 ] [ 3.9910823e-10 2.0822335e-10 2.3563979e-10 ] [ 4.2011008e-10 4.0981654e-10 3.4183464e-10 ] [ 2.5522445e-10 3.5370451e-10 4.9137162e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -3.3e-06 1.69e-05 ] [ -1.96e-05 6.4e-06 -2.06e-05 ] [ -6.1e-06 2.66e-05 -1.64e-05 ] [ -6.7e-06 1.1e-06 -1.7e-06 ] [ 1.31e-05 -9.9e-06 2.3e-05 ] [ 7.9e-06 -7.2e-06 8.1e-06 ] [ 1.39e-05 -1.36e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.165659248399999e-15 -5.2871828922e-15 2.70767851146e-14 ] [ -3.140266202639999e-14 1.02539304576e-14 -3.300483866039999e-14 ] [ -9.773277467399999e-15 4.26178984644e-14 -2.62756967976e-14 ] [ -1.07345834478e-14 1.7623942974e-15 -2.7237002778e-15 ] [ 2.09885139054e-14 -1.58615486766e-14 3.6850062582e-14 ] [ 1.26571954086e-14 -1.15356717648e-14 1.29776307354e-14 ] [ 2.22702552126e-14 -2.17896022224e-14 -1.47400250328e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }