{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8703564 2.1267451 -0.6211286 ] [ 1.4987701 -1.4895604 -0.1273137 ] [ -0.402749 2.9259258 1.1480944 ] [ 0.9524366 -0.3182979 -1.9908525 ] [ 0.9605645 -0.1608257 -0.6816161 ] [ -1.9091332 -1.6794441 1.1459744 ] [ -0.2295326 -1.4045428 1.1268421 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.394464675843653e-09 3.407421277620958e-09 -9.951577214302349e-10 ] [ 2.401294414174078e-09 -2.386538848149496e-09 -2.03979033647545e-10 ] [ -6.452750318505793e-10 4.687849910955536e-09 1.839450006151404e-09 ] [ 1.525971653314241e-09 -5.099694538297364e-10 -3.189697330961232e-09 ] [ 1.538993984670442e-09 -2.576711765637946e-10 -1.092069379780875e-09 ] [ -3.058768579033091e-09 -2.690766072960497e-09 1.836053391715308e-09 ] [ -3.677517654314381e-10 -2.25032563707297e-09 1.805400067953176e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.079587 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.819281105471961e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9412017 4.0013666 3.1777881 ] [ 5.5009482 2.1943609 1.4842463 ] [ 3.6069878 1.0204707 0.780101 ] [ 3.2897371 1.5991791 3.0218375 ] [ 5.1233879 3.027918 3.7378943 ] [ 4.9086948 4.5309454 1.8096573 ] [ 3.0484475 3.2883797 0.8547626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9412017e-10 4.0013666e-10 3.1777881e-10 ] [ 5.5009482e-10 2.1943609e-10 1.4842463e-10 ] [ 3.606987800000001e-10 1.0204707e-10 7.80101e-11 ] [ 3.2897371e-10 1.5991791e-10 3.0218375e-10 ] [ 5.1233879e-10 3.027918e-10 3.7378943e-10 ] [ 4.9086948e-10 4.5309454e-10 1.8096573e-10 ] [ 3.0484475e-10 3.2883797e-10 8.547626000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.11e-05 1.92e-05 1.38e-05 ] [ 2.67e-05 -2.52e-05 -1.2e-05 ] [ -1.83e-05 2.13e-05 -7.1e-06 ] [ -3.6e-06 -1.25e-05 8.8e-06 ] [ 6.6e-06 1.4e-06 -6.2e-06 ] [ -5e-06 2.18e-05 -1e-06 ] [ 2.46e-05 -2.58e-05 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.982769290688e-14 3.076179111936e-14 2.211003736704e-14 ] [ 4.277811577536e-14 -4.037485084416e-14 -1.92261194496e-14 ] [ -2.931983216064e-14 3.412636202304e-14 -1.137545400768e-14 ] [ -5.76783583488e-15 -2.002720776e-14 1.409915426304e-14 ] [ 1.057436569728e-14 2.24304726912e-15 -9.93349504896e-15 ] [ -8.010883104e-15 3.492745033344e-14 -1.6021766208e-15 ] [ 3.941354487168e-14 -4.133615681664e-14 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.25324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.16753870730514e-18 } }