{ "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" [ [ 0.9096143 -0.03346 0.4673601 ] [ -0.4059396 -0.9197776 -0.1907376 ] [ 0.698789 0.0110781 0.6089022 ] [ -0.3412141 0.5042838 -1.2875446 ] [ -0.8612496 0.4378757 0.4020199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.457362765405357e-09 -5.360882973196799e-11 7.4879342571475e-10 ] [ -6.503869365769037e-10 -1.473646167055534e-09 -3.055953234275021e-10 ] [ 1.119583398672211e-09 1.774907282288448e-11 9.755688691936857e-10 ] [ -5.466852537073133e-10 8.07951714608183e-10 -2.062873856357287e-09 ] [ -1.379873973793352e-09 7.015542093564345e-10 6.441068848763539e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.961128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.236819288159626e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9549357 0.2813642 2.6265246 ] [ 2.7658963 3.0213068 3.2263189 ] [ 1.26019 2.3525393 1.5354893 ] [ 2.4606298 0.9501386 4.3173593 ] [ 3.2165973 0.959436 1.992386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.549357e-11 2.813642e-11 2.6265246e-10 ] [ 2.7658963e-10 3.0213068e-10 3.2263189e-10 ] [ 1.26019e-10 2.3525393e-10 1.5354893e-10 ] [ 2.4606298e-10 9.501386000000001e-11 4.3173593e-10 ] [ 3.2165973e-10 9.59436e-11 1.992386e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 2e-07 -8e-07 ] [ -2.6e-06 1.4e-06 -3.4e-06 ] [ -3.8e-06 6.6e-06 -8.4e-06 ] [ 9e-06 -7.3e-06 3.1e-06 ] [ 5e-07 -9e-07 9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 3.2043532416e-16 -1.28174129664e-15 ] [ -4.16565921408e-15 2.24304726912e-15 -5.44740051072e-15 ] [ -6.08827115904e-15 1.057436569728e-14 -1.345828361472e-14 ] [ 1.44195895872e-14 -1.169588933184e-14 4.96674752448e-15 ] [ 8.010883104e-16 -1.44195895872e-15 1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }