{ "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" [ [ 2.786609 1.867113 1.082186 ] [ 2.283835 1.161691 2.913478 ] [ 2.881264 2.452205 4.60424 ] [ 1.739559 3.43443 2.357326 ] [ 4.554937 2.252479 3.113794 ] [ 4.190396 3.99304 2.000834 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.786609e-10 1.867113e-10 1.082186e-10 ] [ 2.283835e-10 1.161691e-10 2.913478e-10 ] [ 2.881264e-10 2.452205e-10 4.60424e-10 ] [ 1.739559e-10 3.43443e-10 2.357326e-10 ] [ 4.554937e-10 2.252479e-10 3.113794e-10 ] [ 4.190396e-10 3.99304e-10 2.000834e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8447408 2.1393314 -3.3435667 ] [ -1.886367 -3.4808882 2.7948208 ] [ -0.9035496 1.7909881 1.0479818 ] [ 0.324305 0.7887124 1.3104852 ] [ 1.2888927 -3.0032236 0.2234806 ] [ -1.6680219 1.7650799 -2.0332018 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.557777201995889e-09 3.427586753223333e-09 -5.356984396825407e-09 ] [ -3.022293105648633e-09 -5.576997693658595e-09 4.477796545085552e-09 ] [ -1.447646044853191e-09 2.869479261951013e-09 1.679051938983902e-09 ] [ 5.19593889008544e-10 1.263656567815058e-09 2.099628749344412e-09 ] [ 2.065033750659788e-09 -4.811694638954812e-09 3.580553925223565e-10 ] [ -2.672465691162396e-09 2.827969749624002e-09 -3.257548389328478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.242557 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.884085805381139e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1308449 2.070206 0.9863308 ] [ 2.2283169 1.0357462 3.0519916 ] [ 3.0146912 2.9834444 4.370959 ] [ 1.5367531 3.3293085 2.4093975 ] [ 4.6087773 1.7243497 2.947888 ] [ 3.9172167 4.0179031 2.3052911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1308449e-10 2.070206e-10 9.863308e-11 ] [ 2.2283169e-10 1.0357462e-10 3.0519916e-10 ] [ 3.0146912e-10 2.983444400000001e-10 4.370959e-10 ] [ 1.5367531e-10 3.3293085e-10 2.4093975e-10 ] [ 4.6087773e-10 1.7243497e-10 2.947888e-10 ] [ 3.9172167e-10 4.0179031e-10 2.3052911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 -1.82e-05 6.86e-05 ] [ 4.14e-05 9.55e-05 -3.87e-05 ] [ -3.44e-05 2.55e-05 -0.0001302 ] [ 0.0001031 -5.48e-05 5.99e-05 ] [ -3.45e-05 -1.43e-05 -2.52e-05 ] [ -6e-05 -3.37e-05 6.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48337376224e-14 -2.915961449856e-14 1.0990931618688e-13 ] [ 6.633011210111999e-14 1.530078672864e-13 -6.200423522496e-14 ] [ -5.511487575552001e-14 4.08555038304e-14 -2.0860339602816e-13 ] [ 1.6518440960448e-13 -8.779927881984e-14 9.597037958592001e-14 ] [ -5.52750934176e-14 -2.291112567744e-14 -4.037485084416e-14 ] [ -9.6130597248e-14 -5.399335212096e-14 1.0510278632448e-13 ] ] } "relaxed-potential-energy" { "source-value" -27.549081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.413849350272549e-18 } }