{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3801033 1.1917207 -0.0696657 ] [ -1.1965996 -7.4266736 0.2676088 ] [ -6.9354257 -1.2819438 -1.1076457 ] [ 2.3428343 7.2403695 2.6627658 ] [ -0.646666 -0.1205403 -0.2783943 ] [ 3.8725856 2.3805674 -0.1030552 ] [ 2.1831681 -1.9834999 -1.3716137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.089926207489286e-10 1.909347044063411e-09 -1.116167558116665e-10 ] [ -1.917163903578632e-09 -1.189884281223257e-08 4.28756562880343e-10 ] [ -1.111177691183547e-08 -2.053900385539511e-09 -1.774644044669651e-09 ] [ 3.753634341868333e-09 1.160035073885339e-08 4.266221111425809e-09 ] [ -1.036073146666253e-09 -1.931268505242183e-10 -4.460368388239814e-10 ] [ 6.20456611036674e-09 3.814089432518642e-09 -1.651126320918682e-10 ] [ 3.497820889096356e-09 -3.177917167139138e-09 -2.197567402908985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.257689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.764986584483733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0386894 1.0976071 1.8694603 ] [ 1.997736 2.3936082 3.6300215 ] [ 1.6011291 4.0509265 1.8010074 ] [ 2.9015363 4.6043028 3.8216766 ] [ 4.3636589 2.6271823 3.2096693 ] [ 3.7101114 5.3755246 1.674947 ] [ 3.5667298 3.1154131 0.7541235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0386894e-10 1.0976071e-10 1.8694603e-10 ] [ 1.997736e-10 2.3936082e-10 3.6300215e-10 ] [ 1.6011291e-10 4.0509265e-10 1.8010074e-10 ] [ 2.9015363e-10 4.6043028e-10 3.8216766e-10 ] [ 4.3636589e-10 2.6271823e-10 3.2096693e-10 ] [ 3.7101114e-10 5.375524600000001e-10 1.674947e-10 ] [ 3.5667298e-10 3.1154131e-10 7.541235e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2091355 -0.1204595 0.1763623 ] [ -1.1022847 -0.5550936 -0.2518497 ] [ -0.1670377 0.0001206 0.2030266 ] [ 0.9887085 0.2679326 -0.0164228 ] [ 0.1389205 0.3288421 0.1310491 ] [ -0.2761255 -0.1436307 -0.0711976 ] [ 0.2086834 0.2222884 -0.1709678 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.350720086793184e-10 -1.929973946532576e-10 2.825635538505158e-10 ] [ -1.766054775805542e-09 -8.893579882757068e-10 -4.035077012954938e-10 ] [ -2.676238977322042e-10 1.9322250046848e-13 3.252844719205133e-10 ] [ 1.584085643486237e-09 4.292753476701581e-10 -2.631222620807424e-11 ] [ 2.225751772498464e-10 5.268631245547757e-10 2.099638041968813e-10 ] [ -4.424018205067105e-10 -2.301217495691386e-10 -1.140711301770701e-10 ] [ 3.343476646290547e-10 3.561452775550387e-10 -2.739206120696103e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.087052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.378518171599388e-18 } }