Details
Title
Penfold, Thomas James
Sciper ID
202254
Affiliated labs
LCBC
Publications
A Theoretical Rationalisation of the Emission Properties of Prototypical Cu(I)-Phenanthroline Complexes
Derivation of spin-orbit couplings in collinear linear-response TDDFT: A rigorous formulation
Local control theory in trajectory-based nonadiabatic dynamics
Mixed Quantum Mechanical/Molecular Mechanical (QM/MM) simulations of Adiabatic and Nonadiabatic Ultrafast Phenomena
Probing the electronic and geometric structure of ferric and ferrous myoglobins in physiological solutions by Fe K-edge absorption spectroscopy
Pushing the Frontiers of First-Principles Based Computer Simulations of Chemical and Biological Systems
Simulations of X-ray absorption spectra: the effect of the solvent
Solvent Induced Luminescence Quenching: Static and Time-Resolved X-Ray Absorption Spectroscopy of a Copper(I) Phenanthroline Complex
The role of Hartree-Fock exchange in the simulation of X-ray absorption spectra: A study of photoexcited [Fe(bpy)(3)](2+)
Ultrafast anisotropic x-ray scattering in the condensed phase
See complete list of publications (21)
Derivation of spin-orbit couplings in collinear linear-response TDDFT: A rigorous formulation
Local control theory in trajectory-based nonadiabatic dynamics
Mixed Quantum Mechanical/Molecular Mechanical (QM/MM) simulations of Adiabatic and Nonadiabatic Ultrafast Phenomena
Probing the electronic and geometric structure of ferric and ferrous myoglobins in physiological solutions by Fe K-edge absorption spectroscopy
Pushing the Frontiers of First-Principles Based Computer Simulations of Chemical and Biological Systems
Simulations of X-ray absorption spectra: the effect of the solvent
Solvent Induced Luminescence Quenching: Static and Time-Resolved X-Ray Absorption Spectroscopy of a Copper(I) Phenanthroline Complex
The role of Hartree-Fock exchange in the simulation of X-ray absorption spectra: A study of photoexcited [Fe(bpy)(3)](2+)
Ultrafast anisotropic x-ray scattering in the condensed phase
See complete list of publications (21)
Use for
Penfold, Thomas J.
Penfold, T. J.
Penfold, T J
Penfold, T. J.
Penfold, T J
Link to search
All resources
Record appears in
Authorities > People