- Home
- Publications
- Publication Search
- Publication Details
Title
Non-equilibrium x-ray spectroscopy using direct quantum dynamics
Authors
Keywords
-
Journal
JOURNAL OF CHEMICAL PHYSICS
Volume 149, Issue 12, Pages 124107
Publisher
AIP Publishing
Online
2018-09-26
DOI
10.1063/1.5047487
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Ab Initio Nonadiabatic Quantum Molecular Dynamics
- (2018) Basile F. E. Curchod et al. CHEMICAL REVIEWS
- Curve Crossing in a Manifold of Coupled Electronic States: Direct Quantum Dynamics Simulations of Formamide
- (2018) Kaite Eryn Spinlove et al. FARADAY DISCUSSIONS
- Simulation of Ultra-Fast Dynamics Effects in Resonant Inelastic X-ray Scattering of Gas-Phase Water
- (2018) Adam E. A. Fouda et al. Journal of Chemical Theory and Computation
- Ultrafast X-Ray Spectroscopy of Conical Intersections
- (2018) Simon P. Neville et al. PHYSICAL REVIEW LETTERS
- Curve Crossing in a Manifold of Coupled Electronic States: Direct Quantum Dynamics Simulations of Formamide
- (2018) Kaite Eryn Spinlove et al. FARADAY DISCUSSIONS
- Nuclear Dynamical Correlation Effects in X-ray Spectroscopy from a Theoretical Time-Domain Perspective
- (2017) Sven Karsten et al. Journal of Physical Chemistry Letters
- Attosecond Charge Migration with TDDFT: Accurate Dynamics from a Well-Defined Initial State
- (2017) Adam Bruner et al. Journal of Physical Chemistry Letters
- Ultrafast Intersystem Crossing in Acetylacetone via Femtosecond X-ray Transient Absorption at the Carbon K-Edge
- (2017) Aditi Bhattacherjee et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Accelerating direct quantum dynamics using graphical processing units
- (2017) T. J. Penfold PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- A study of the water molecule using frequency control over nuclear dynamics in resonant X-ray scattering
- (2017) Vinícius Vaz da Cruz et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Femtosecond x-ray spectroscopy of an electrocyclic ring-opening reaction
- (2017) Andrew R. Attar et al. SCIENCE
- Time-resolved x-ray absorption spectroscopy with a water window high-harmonic source
- (2017) Yoann Pertot et al. SCIENCE
- Probing spin–vibronic dynamics using femtosecond X-ray spectroscopy
- (2016) T. J. Penfold et al. FARADAY DISCUSSIONS
- Beyond structure: ultrafast X-ray absorption spectroscopy as a probe of non-adiabatic wavepacket dynamics
- (2016) Simon P. Neville et al. FARADAY DISCUSSIONS
- Excited state X-ray absorption spectroscopy: Probing both electronic and structural dynamics
- (2016) Simon P. Neville et al. JOURNAL OF CHEMICAL PHYSICS
- Establishing nonlinearity thresholds with ultraintense X-ray pulses
- (2016) Jakub Szlachetko et al. Scientific Reports
- Probing spin–vibronic dynamics using femtosecond X-ray spectroscopy
- (2016) T. J. Penfold et al. FARADAY DISCUSSIONS
- Beyond structure: ultrafast X-ray absorption spectroscopy as a probe of non-adiabatic wavepacket dynamics
- (2016) Simon P. Neville et al. FARADAY DISCUSSIONS
- Quantum dynamics simulations using Gaussian wavepackets: the vMCG method
- (2015) G.W. Richings et al. INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY
- Probing charge transfer dynamics in self-assembled monolayers by core hole clock approach
- (2015) Michael Zharnikov JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA
- Probing wavepacket dynamics using ultrafast x-ray spectroscopy
- (2015) G Capano et al. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS
- Imaging Molecular Motion: Femtosecond X-Ray Scattering of an Electrocyclic Chemical Reaction
- (2015) M. P. Minitti et al. PHYSICAL REVIEW LETTERS
- Electron Dynamics in the Core-ExcitedCS2Molecule Revealed through Resonant Inelastic X-Ray Scattering Spectroscopy
- (2015) T. Marchenko et al. Physical Review X
- Recent experimental and theoretical developments in time-resolved X-ray spectroscopies
- (2014) C.J. Milne et al. COORDINATION CHEMISTRY REVIEWS
- Dissociation dynamics of simple chlorine containing molecules upon resonant Cl K-σ* excitation
- (2014) R. Bohinc et al. JOURNAL OF CHEMICAL PHYSICS
- Ab initio multiple cloning algorithm for quantum nonadiabatic molecular dynamics
- (2014) Dmitry V. Makhov et al. JOURNAL OF CHEMICAL PHYSICS
- Calculating core-level excitations and x-ray absorption spectra of medium-sized closed-shell molecules with the algebraic-diagrammatic construction scheme for the polarization propagator
- (2014) Jan Wenzel et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
- (2014) Yihan Shao et al. MOLECULAR PHYSICS
- Inelastic X-ray Scattering of a Transition-Metal Complex (FeCl4–): Vibrational Spectroscopy for All Normal Modes
- (2013) Weibing Dong et al. INORGANIC CHEMISTRY
- Dissociation limit and dissociation dynamic of CF4+: Application of threshold photoelectron-photoion coincidence velocity imaging
- (2013) Xiaofeng Tang et al. JOURNAL OF CHEMICAL PHYSICS
- Dissociation of chloromethanes upon resonant σ* excitation studied by x-ray scattering
- (2013) R. Bohinc et al. JOURNAL OF CHEMICAL PHYSICS
- High-resolution resonant inelastic soft X-ray scattering applied to liquids
- (2013) Jan-Erik Rubensson et al. JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA
- Femtosecond X-ray Absorption Spectroscopy at a Hard X-ray Free Electron Laser: Application to Spin Crossover Dynamics
- (2013) Henrik T. Lemke et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Nuclear dynamics and spectator effects in resonant inelastic soft x-ray scattering of gas-phase water molecules
- (2012) Lothar Weinhardt et al. JOURNAL OF CHEMICAL PHYSICS
- A compact X-ray free-electron laser emitting in the sub-ångström region
- (2012) Tetsuya Ishikawa et al. Nature Photonics
- Highly coherent and stable pulses from the FERMI seeded free-electron laser in the extreme ultraviolet
- (2012) E. Allaria et al. Nature Photonics
- Bright Coherent Ultrahigh Harmonics in the keV X-ray Regime from Mid-Infrared Femtosecond Lasers
- (2012) T. Popmintchev et al. SCIENCE
- Spatial Quantum Beats in Vibrational Resonant Inelastic Soft X-Ray Scattering at Dissociating States in Oxygen
- (2011) A. Pietzsch et al. PHYSICAL REVIEW LETTERS
- First lasing and operation of an ångstrom-wavelength free-electron laser
- (2010) P. Emma et al. Nature Photonics
- Semiclassical description of nuclear dynamics in x-ray emission of water
- (2010) M. P. Ljungberg et al. PHYSICAL REVIEW B
- Resonant Inelastic Scattering Spectra of Free Molecules with Vibrational Resolution
- (2010) Franz Hennies et al. PHYSICAL REVIEW LETTERS
- Bright, Coherent, Ultrafast Soft X-Ray Harmonics Spanning the Water Window from a Tabletop Light Source
- (2010) M.-C. Chen et al. PHYSICAL REVIEW LETTERS
- Quantum mechanics with the basis set guided by Ehrenfest trajectories: Theory and application to spin-boson model
- (2009) Dmitrii V. Shalashilin JOURNAL OF CHEMICAL PHYSICS
- A model Hamiltonian to simulate the complex photochemistry of benzene II
- (2009) Thomas J. Penfold et al. JOURNAL OF CHEMICAL PHYSICS
- Molecular dynamics simulations of fine structure in oxygenK-edge x-ray emission spectra of liquid water and ice
- (2009) Michael Odelius PHYSICAL REVIEW B
- Single-Shot Diffractive Imaging with a Table-Top Femtosecond Soft X-Ray Laser-Harmonics Source
- (2009) A. Ravasio et al. PHYSICAL REVIEW LETTERS
- Multimode quantum dynamics using Gaussian wavepackets: The Gaussian-based multiconfiguration time-dependent Hartree (G-MCTDH) method applied to the absorption spectrum of pyrazine
- (2008) I. Burghardt et al. JOURNAL OF CHEMICAL PHYSICS
- Self-Consistent Field Calculations of Excited States Using the Maximum Overlap Method (MOM)†
- (2008) Andrew T. B. Gilbert et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Coherent Water Window X Ray by Phase-Matched High-Order Harmonic Generation in Neutral Media
- (2008) Eiji J. Takahashi et al. PHYSICAL REVIEW LETTERS
Create your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create NowAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started