{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.2183073 -9.8792866 6.3111497 ] [ -3.4914101 -0.028839 3.833803 ] [ 8.9853608 -0.4236658 -8.9033962 ] [ 16.0084204 -5.1456936 24.0217461 ] [ -4.2840639 15.477485 -25.2633026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.758676940580997e-08 -1.582836202070272e-08 1.011157649970893e-08 ] [ -5.593855635844991e-09 -4.62051715672512e-11 6.142429535352903e-09 ] [ 1.439613500321279e-08 -6.787874397925286e-10 -1.426481323735956e-08 ] [ 2.564831690081778e-08 -8.244309983720188e-09 3.848707999221358e-08 ] [ -6.863827022593269e-09 2.479766461578269e-08 -4.047627278991585e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.8532127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.258223378610964e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5795189 0.5337455 2.6895661 ] [ -0.0678555 2.1548226 1.4155141 ] [ 3.0790178 1.1034624 0.3116189 ] [ 2.5243836 -0.1160521 2.007286 ] [ 1.4769239 2.5069491 -0.054121 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.795189e-11 5.337455e-11 2.6895661e-10 ] [ -6.78555e-12 2.1548226e-10 1.4155141e-10 ] [ 3.0790178e-10 1.1034624e-10 3.116189e-11 ] [ 2.5243836e-10 -1.160521e-11 2.007286e-10 ] [ 1.4769239e-10 2.5069491e-10 -5.4121e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.14e-05 -1.07e-05 -8.8e-06 ] [ 1.1e-06 -2.4e-06 2.55e-05 ] [ 2.8e-05 1.17e-05 -3.98e-05 ] [ -9.9e-06 -2.22e-05 5.28e-05 ] [ -7.8e-06 2.36e-05 -2.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.826481347712e-14 -1.714328984256e-14 -1.409915426304e-14 ] [ 1.76239428288e-15 -3.84522388992e-15 4.08555038304e-14 ] [ 4.48609453824e-14 1.874546646336e-14 -6.376662950784e-14 ] [ -1.586154854592e-14 -3.556832098176e-14 8.459492557824e-14 ] [ -1.249697764224e-14 3.781136825088e-14 -4.758464563776e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.012367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924593356786943e-18 } }