SEARCH Articles Figures Tables Adiabatic diabatic transformation Adiabatic-diabatic representation Adiabatic-to-diabatic transformation Adiabatic-to-diabatic transformation angle Adiabatic-to-diabatic transformation diabatization matrix Adiabatic-to-diabatic transformation equation Adiabatic-to-diabatic transformation matrix Adiabatic-to-diabatic transformation matrix quantization Adiabatic-to-diabatic transformation two-state application Approximate Representation of the Diabatic Electronic Wavefunction Approximations , Adiabatic diabatic Avoided crossing diabatic/adiabatic dynamics Base electronic states, diabatic Choice between the Diabatic and Adiabatic Models Circulation diabatic Comparison between Diabatic and Adiabatic Parameters Completely diabatic basis Conical intersections minimal diabatic potential matrix Consistent diabatic configurations Counter-diabatic field Coupling diabatic channel Crossing or Diabatic Curves Curve crossing diabatic Definition of Diabatic States Diabatic Energy Surfaces Diabatic Hamiltonian weakness, adiabatic Diabatic Hamiltonian weakness, adiabatic coupling Diabatic and adiabatic potential Diabatic and adiabatic potential curves Diabatic and adiabatic representation Diabatic and adiabatic states Diabatic approximations Diabatic bases Diabatic basis Diabatic basis set Diabatic column Diabatic constraint, defined Diabatic coupling Diabatic coupling elements Diabatic crossing Diabatic crossings, dissociation Diabatic curves Diabatic definition Diabatic distillation configuration Diabatic electron transfer free energy surfaces Diabatic electron wave function Diabatic electronic basis Diabatic electronic basis sets Diabatic electronic representation, adiabatic Diabatic electronic representation, adiabatic basis Diabatic electronic states Diabatic electronically Diabatic energy Diabatic energy difference Diabatic energy hypersurfaces Diabatic flow Diabatic free energy model Diabatic free energy profiles Diabatic functions Diabatic heating Diabatic heating rates Diabatic hop Diabatic mixing Diabatic photoreactions Diabatic population Diabatic population probability, nonadiabatic Diabatic population probability, nonadiabatic quantum dynamics Diabatic potential curves Diabatic potential energy Diabatic potential energy surfaces Diabatic potential matrix Diabatic potential matrix, minimal conditions Diabatic potentials Diabatic potentials, nonadiabatic transition Diabatic process Diabatic reaction Diabatic reaction, definition Diabatic representation Diabatic representation defined Diabatic representation transformation Diabatic solvent reorganization energy Diabatic state Diabatic state regularized Diabatic states Hamiltonian Diabatic states model Diabatic states, energy profiles Diabatic surfaces Diabatic templates Diabatic vibronic Hamiltonian Diabatic wall Diabatic wave functions Diabatic wavefunction Diabatic-adiabatic coincidence Diabatization Diabatization Diabatization matrix, electronic states Diabatization, coupled electronic/nuclear Direct molecular dynamics diabatic properties Effective diabatic states Electromagnetic Field-Dressed Diabatic and Adiabatic Potential Energy Curves Electron diabatic Electron transfer diabatic Electronic Diabatic States Definition, Computation, and Electronic states diabatic nuclear motion Schrodinger Electronic states diabatic representation Electronic states electronically diabatic representation Electronic states, adiabatic-to-diabatic Electronic states, adiabatic-to-diabatic transformation, two-state system Electronic transitions diabatic basis sets Field ionization diabatic Flow, adiabatic diabatic Force diabatization Free diabatic Generalized electronic diabatic Generalized electronic diabatic approach Ionic diabatic surfaces Local diabatization Minimal diabatic potential matrix Minimal diabatic potential matrix noninteracting intersections Molecular potential diabatic states Molecular systems Wigner rotation/adiabatic-to-diabatic Nearly diabatic potential surfaces Non-adiabatic coupling minimal diabatic potential matrix Non-adiabatic coupling single-valued diabatic potentials and Nonadiabatic effects diabatic states Nuclear motion Schrodinger equation diabatic representation On diabatic representation Optimal distillation column diabatic configuration Photochemical diabatic Photochemical reactions diabatic Potential energy curves diabatic Predissociation for a pair of states intermediate between adiabatic and diabatic coupling limits Proton transfer diabatic/adiabatic Quasi-diabatic representation Quasi-diabatic states Representation electronically diabatic Schrodinger equation diabatic representation Schrodinger equation diabatization State-specific diabatic states Strictly diabatic Strictly diabatic basis Strictly diabatic states Surface diabatic free energy The diabatic representation Three-state molecular system, non-adiabatic minimal diabatic potential matrix Transformation from adiabatic diabatic basis Transition state theory diabatic Valence Bond Calculations of Diabatic States and Resonance Energies Vibronic coupling, diabatic representation