{ "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" [ [ 1.063375 0.5708417 2.359419 ] [ 2.68579 2.886891 2.868985 ] [ 0.6763911 2.686272 1.583941 ] [ 2.607368 0.7750333 4.497523 ] [ 3.625325 0.6457468 2.38821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.063375e-10 5.708417e-11 2.359419e-10 ] [ 2.68579e-10 2.886891e-10 2.868985e-10 ] [ 6.763911e-11 2.686272e-10 1.583941e-10 ] [ 2.607368e-10 7.750333e-11 4.497523e-10 ] [ 3.625325e-10 6.457468e-11 2.38821e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.7712977 1.0215837 2.188331 ] [ -1.2009047 -3.9337936 0.5142793 ] [ -0.1670211 1.0682398 -0.293549 ] [ -1.2299776 1.3775062 -2.0412448 ] [ -1.1733942 0.4664638 -0.3678166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.042285005016812e-09 1.636757520330361e-09 3.506092766771885e-09 ] [ -1.924061434148838e-09 -6.302632136972668e-09 8.239662710213894e-10 ] [ -2.675973016002989e-10 1.711508832968068e-09 -4.703173448592193e-10 ] [ -1.970641354827694e-09 2.207008228647049e-09 -3.270434695889572e-09 ] [ -1.879984754222319e-09 7.47357394809527e-10 -5.893071572621454e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.266709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.445996423635695e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2837475 0.6533138 2.3853752 ] [ 2.6131747 2.6714539 2.8367176 ] [ 0.5582718 2.7963518 1.6354033 ] [ 2.5039085 0.8831465 4.4593066 ] [ 3.6991466 0.5605188 2.3812753 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2837475e-10 6.533137999999999e-11 2.3853752e-10 ] [ 2.6131747e-10 2.6714539e-10 2.8367176e-10 ] [ 5.582718e-11 2.7963518e-10 1.6354033e-10 ] [ 2.5039085e-10 8.831465e-11 4.4593066e-10 ] [ 3.6991466e-10 5.605188e-11 2.3812753e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.01e-05 -4.3e-05 9e-06 ] [ 4.8e-05 5.91e-05 -1.49e-05 ] [ 1.72e-05 -1.78e-05 5.6e-06 ] [ -5.12e-05 -1.83e-05 6.23e-05 ] [ 4.61e-05 2.01e-05 -6.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.629081491008e-14 -6.889359469439999e-14 1.44195895872e-14 ] [ 7.69044777984e-14 9.468863828927999e-14 -2.387243164992e-14 ] [ 2.755743787776e-14 -2.851874385024e-14 8.972189076479999e-15 ] [ -8.203144298496001e-14 -2.931983216064e-14 9.981560347584e-14 ] [ 7.386034221888001e-14 3.220375007808e-14 -9.93349504896e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.5414 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650224435530112e-18 } }