{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2919425 2.67516 1.746269 ] [ 2.438709 2.093987 1.463313 ] [ 1.581807 3.429392 0.2359452 ] [ 3.672756 4.324894 1.563989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.919425e-11 2.67516e-10 1.746269e-10 ] [ 2.438709e-10 2.093987e-10 1.463313e-10 ] [ 1.581807e-10 3.429392e-10 2.359452e-11 ] [ 3.672756e-10 4.324894e-10 1.563989e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3870413 -0.6842583 1.6705885 ] [ 2.9003863 -1.1805695 1.9739453 ] [ 1.0465715 3.4625156 -2.8536743 ] [ -1.5599165 -1.5976878 -0.7908595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.824461763744039e-09 -1.096302650848353e-09 2.676577837677341e-09 ] [ 4.646931121148615e-09 -1.891480852129546e-09 3.162609010398042e-09 ] [ 1.676792389295587e-09 5.547561543475285e-09 -4.572090246837806e-09 ] [ -2.499261746700163e-09 -2.559778040497387e-09 -1.267096601237578e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2215542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.477455854668005e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5067845 2.4156054 1.39259 ] [ 2.5859907 2.0895768 2.2049853 ] [ 1.4066124 4.1721543 0.2997972 ] [ 3.4858269 3.8460965 1.1121437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.067845e-11 2.4156054e-10 1.39259e-10 ] [ 2.5859907e-10 2.0895768e-10 2.2049853e-10 ] [ 1.4066124e-10 4.1721543e-10 2.997972e-11 ] [ 3.4858269e-10 3.8460965e-10 1.1121437e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -3.52e-05 4.01e-05 ] [ -4.4e-06 -3.09e-05 9e-06 ] [ -3.18e-05 6.51e-05 -7.15e-05 ] [ 3.62e-05 1e-06 2.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -5.639661705216e-14 6.424728249408e-14 ] [ -7.04957713152e-15 -4.950725758272e-14 1.44195895872e-14 ] [ -5.094921654144e-14 1.0430169801408e-13 -1.145556283872e-13 ] [ 5.799879367296e-14 1.6021766208e-15 3.588875630592e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736330714483474e-18 } }