{ "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" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6752364 0.5098587 0.1500171 ] [ -0.1763041 -0.2361628 0.2119173 ] [ 13.0415485 7.9427737 1.5159885 ] [ -13.0665541 -7.8656124 -0.571085 ] [ -0.4739267 -0.3508571 -1.3068379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.081847973593157e-09 8.16883689051481e-10 2.403538903402157e-10 ] [ -2.824703071711852e-10 -3.783745168626663e-10 3.395289436030598e-10 ] [ 2.089486410572931e-08 1.272572632644511e-08 2.428881332101661e-09 ] [ -2.093492749343838e-08 -1.260210029555458e-08 -9.14979035489568e-10 ] [ -7.593142787128953e-10 -5.621350428616877e-10 -2.093785130555369e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.0554406 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.099708737163125e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5555364 1.2996258 2.2635467 ] [ 2.4998033 -0.1361278 1.0902933 ] [ 2.8297263 3.2172521 0.6094662 ] [ 1.2111404 1.6190658 -0.1170213 ] [ 2.9722116 1.827655 2.5460927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.555364000000001e-11 1.2996258e-10 2.2635467e-10 ] [ 2.4998033e-10 -1.361278e-11 1.0902933e-10 ] [ 2.8297263e-10 3.2172521e-10 6.094662e-11 ] [ 1.2111404e-10 1.6190658e-10 -1.170213e-11 ] [ 2.9722116e-10 1.827655e-10 2.5460927e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 2e-07 4.8e-06 ] [ 2.2e-06 -6.8e-06 -1e-06 ] [ 1.5e-06 4.3e-06 -1e-06 ] [ -2.5e-06 7e-07 -7.4e-06 ] [ 3.9e-06 1.6e-06 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.17110076608e-15 3.2043532416e-16 7.69044777984e-15 ] [ 3.52478856576e-15 -1.089480102144e-14 -1.6021766208e-15 ] [ 2.4032649312e-15 6.889359469440001e-15 -1.6021766208e-15 ] [ -4.005441552e-15 1.12152363456e-15 -1.185610699392e-14 ] [ 6.24848882112e-15 2.56348259328e-15 7.370012455680001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }