{ "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" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -17.8823895 6.1864004 3.1490681 ] [ 4.4429582 0.0266239 -5.1868679 ] [ 13.4394313 -6.2130243 2.0377998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -2.86507463809394e-08 9.911706087787769e-09 5.045363287127077e-09 ] [ 7.11840375523165e-09 4.265619013451712e-11 -8.310278484557993e-09 ] [ 2.153234262570775e-08 -9.954362277922287e-09 3.264915197430916e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.336448 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.141225740514919e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9136055 0.1992462 0.0711002 ] [ -0.253094 0.1716625 3.6991577 ] [ 0.883684 1.8435068 2.8318741 ] [ 3.9681718 3.3177182 0.163852 ] [ 2.348775 2.9352724 1.6023739 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ -2.53094e-11 1.716625e-11 3.6991577e-10 ] [ 8.836840000000001e-11 1.8435068e-10 2.8318741e-10 ] [ 3.9681718e-10 3.3177182e-10 1.63852e-11 ] [ 2.348775e-10 2.9352724e-10 1.6023739e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0519887 -0.0450395 0.0429667 ] [ 0.1656623 0.129545 -0.1385915 ] [ 0.0586645 0.0357272 -0.0500018 ] [ -0.1723381 -0.1202327 0.1456266 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -8.329507968578495e-11 -7.21612339125216e-11 6.884024221292736e-11 ] [ 2.654202640079559e-10 2.07553970341536e-10 -2.220480611416032e-10 ] [ 9.39908903709216e-11 5.724128456664576e-11 -8.011171495791743e-11 ] [ -2.761160746930925e-10 -1.926340209956601e-10 2.333195338865933e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.4091476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.347293968557643e-18 } }