{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7743779 -4.274187 -3.3797062 ] [ -0.1847976 3.369401 2.7293273 ] [ 1.7589085 -0.8451683 0.8651765 ] [ 0.8360354 1.5235054 0.8218126 ] [ 0.3916391 1.3127919 -0.1402238 ] [ -2.0274075 -1.086343 -0.8963864 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2406901670442e-09 -6.84800248432729e-09 -5.414886258812809e-09 ] [ -2.960783942999501e-10 5.398375508300141e-09 4.372864390571189e-09 ] [ 2.818082076826397e-09 -1.35410889090128e-09 1.386165561165571e-09 ] [ 1.339476372041176e-09 2.440924733542552e-09 1.316688934398862e-09 ] [ 6.274750098111534e-10 2.103324490155611e-09 -2.24663294039735e-10 ] [ -3.248264897334576e-09 -1.740513356769734e-09 -1.436169333283077e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.811589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.815037119989846e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7879805 -0.0778551 1.0302594 ] [ 0.4964552 1.3762856 3.0182362 ] [ 0.480681 2.3666134 0.7443447 ] [ 2.6855879 1.3309809 0.2780137 ] [ 2.7013634 0.3406568 2.5519024 ] [ 2.3940593 2.7851211 2.2659983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.879805e-11 -7.78551e-12 1.0302594e-10 ] [ 4.964552e-11 1.3762856e-10 3.0182362e-10 ] [ 4.80681e-11 2.3666134e-10 7.443447e-11 ] [ 2.6855879e-10 1.3309809e-10 2.780137e-11 ] [ 2.7013634e-10 3.406568e-11 2.5519024e-10 ] [ 2.3940593e-10 2.7851211e-10 2.2659983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 1.3e-06 -3.93e-05 ] [ -5e-07 -1.1e-06 3.53e-05 ] [ 4.58e-05 -4.15e-05 1.23e-05 ] [ -2.9e-05 1.58e-05 -1.76e-05 ] [ -2.99e-05 4.7e-06 2.16e-05 ] [ 9.7e-06 2.09e-05 -1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 2.08282960704e-15 -6.296554119743999e-14 ] [ -8.010883104e-16 -1.76239428288e-15 5.655683471424e-14 ] [ 7.337968923264e-14 -6.64903297632e-14 1.970677243584e-14 ] [ -4.64631220032e-14 2.531439060864e-14 -2.819830852608e-14 ] [ -4.790508096192e-14 7.53023011776e-15 3.460701500928e-14 ] [ 1.554111322176e-14 3.348549137472e-14 -1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -27.549081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.413849350272549e-18 } }