Rotationally averaged linear absorption spectra beyond the electric-dipole approximation

A Palette of Fluorescent Thiophene-Based Ligands for the Identification of Protein Aggregates

(2015) Hamid Shirani et al.   CHEMISTRY-A EUROPEAN JOURNAL

Origin invariance in vibrational resonance Raman optical activity

(2015) Luciano N. Vidal et al.   JOURNAL OF CHEMICAL PHYSICS

The consequences of improperly describing oscillator strengths beyond the electric dipole approximation

(2015) Patrick J. Lestrange et al.   JOURNAL OF CHEMICAL PHYSICS

Beyond the electric-dipole approximation: A formulation and implementation of molecular response theory for the description of absorption of electromagnetic field radiation

(2015) Nanna Holmgaard List et al.   JOURNAL OF CHEMICAL PHYSICS

The origin dependence of the material constants: the permittivity and the inverse permeability

(2015) Marco Anelli et al.   MOLECULAR PHYSICS

Rotational averaging of multiphoton absorption cross sections

(2014) Daniel H. Friese et al.   JOURNAL OF CHEMICAL PHYSICS

Efficient Calculations of Molecular Linear Response Properties for Spectral Regions

(2014) Joanna Kauczor et al.   Journal of Chemical Theory and Computation

The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes

(2013) Andrew J. Atkins et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The Dalton quantum chemistry program system

(2013) Kestutis Aidas et al.   Wiley Interdisciplinary Reviews-Computational Molecular Science

Probing the Electronic Structure of Substituted Ferrocenes with High-Resolution XANES Spectroscopy

(2012) Andrew J. Atkins et al.   CHEMISTRY-A EUROPEAN JOURNAL

Origin-independent calculation of quadrupole intensities in X-ray spectroscopy

(2012) Stephan Bernadotte et al.   JOURNAL OF CHEMICAL PHYSICS

On the Efficiency of Algorithms for Solving Hartree–Fock and Kohn–Sham Response Equations

(2011) Joanna Kauczor et al.   Journal of Chemical Theory and Computation

A perspective on nonresonant and resonant electronic response theory for time-dependent molecular properties

(2011) Patrick Norman   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Assignment of pre-edge peaks in K-edge x-ray absorption spectra of 3d transition metal compounds: electric dipole or quadrupole?

(2008) Takashi Yamamoto   X-RAY SPECTROMETRY

Time-dependent density functional calculations of ligand K-edge X-ray absorption spectra

(2007) Serena DeBeer George et al.   INORGANICA CHIMICA ACTA