I'm obligated to use Universal forcefield because I'm doing comparison study with Ta, Nb surface (this metal is not parametrized in other forcefields). The charges were assigned using QEq method (zero to 0.05 e- other options fail for charge ) . For Nb the energies are negative, but for other cases positive (can I assign these values arbitrary as negative to calculate the interaction energy or not) .
Kind regards
Kind regards
