Attosecond Electron Dynamics in Molecules
|
journal
|
May 2017 |
(Sub-)femtosecond control of molecular reactions via tailoring the electric field of light
|
journal
|
January 2013 |
Coherent Electronic Wave Packet Motion in Controlled by the Waveform and Polarization of Few-Cycle Laser Fields
|
journal
|
March 2015 |
An electronic time scale in chemistry
|
journal
|
April 2006 |
Molecular Reaction Dynamics
|
book
|
January 2005 |
Do highly excited reactive polyatomic molecules behave ergodically?
|
journal
|
May 1979 |
Infrared multiphoton dissociation of three nitroalkanes
|
journal
|
July 1986 |
Experimental appraisal of the maximal‐entropy theory of multiphoton ionization‐fragmentation: The alternative ionization pathway test
|
journal
|
December 1981 |
Statistical fragmentation patterns in multiphoton ionization: A comparison with experiment
|
journal
|
December 1981 |
Control of Electron Localization in Molecular Dissociation
|
journal
|
April 2006 |
Electron localization following attosecond molecular photoionization
|
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|
June 2010 |
Ultrafast electron dynamics in phenylalanine initiated by attosecond pulses
|
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|
October 2014 |
Probing Time-Dependent Molecular Dipoles on the Attosecond Time Scale
|
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|
July 2013 |
Direct observation of an attosecond electron wave packet in a nitrogen molecule
|
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|
September 2015 |
Attosecond imaging of molecular electronic wavepackets
|
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|
January 2010 |
Strong-field control and spectroscopy of attosecond electron-hole dynamics in molecules
|
journal
|
September 2009 |
Time-Resolved Dynamics in N2O4 Probed Using High Harmonic Generation
|
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|
November 2008 |
Multi-channel electronic and vibrational dynamics in polyatomic resonant high-order harmonic generation
|
journal
|
January 2015 |
Real-Time Probing of Electron Dynamics Using Attosecond Time-Resolved Spectroscopy
|
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|
May 2016 |
Probing the Dynamics of Rydberg and Valence States of Molecular Nitrogen with Attosecond Transient Absorption Spectroscopy
|
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February 2016 |
State-Resolved Probing of Attosecond Timescale Molecular Dipoles
|
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December 2018 |
Steering Proton Migration in Hydrocarbons Using Intense Few-Cycle Laser Fields
|
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|
May 2016 |
Carrier-envelope-phase dependence of asymmetric C D bond breaking in C2D2 in an intense few-cycle laser field
|
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|
March 2014 |
Carrier-Envelope Phase Control over Pathway Interference in Strong-Field Dissociation of
|
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|
October 2013 |
Attosecond vacuum UV coherent control of molecular dynamics
|
journal
|
January 2014 |
A unified theory of nuclear reactions. II
|
journal
|
August 1962 |
The Low Electronic States of Simple Heteropolar Diatomic Molecules. II. Alkali Metal Hydrides
|
journal
|
December 1936 |
Theoretical Study of the LiH Molecule
|
journal
|
November 1968 |
LiH Potential Curves and Wavefunctions for X 1Σ+, A 1Σ+, B 1Π, 3Σ+, and 3Π
|
journal
|
December 1972 |
Ab initio valence-bond calculations on HF, LiH, LiH + and LiF
|
journal
|
March 1976 |
PNO–CI and CEPA studies of electron correlation effects. III. Spectroscopic constants and dipole moment functions for the ground states of the first‐row and second‐row diatomic hydrides
|
journal
|
September 1975 |
A First Solution, for LiH, of a Molecular Transcorrelated Wave Equation by Means of Restricted Numerical Integration
|
journal
|
July 1969 |
The multiconfiguration time-dependent Hartree–Fock method for quantum chemical calculations
|
journal
|
March 2005 |
Accurate Ab Initio Calculations for LiH and its Ions, LiH+ and LiH−
|
journal
|
February 2006 |
Accurate ab initio determination of the adiabatic potential energy function and the Born–Oppenheimer breakdown corrections for the electronic ground state of LiH isotopologues
|
journal
|
March 2011 |
Spatial and temporal control of populations, branching ratios, and electronic coherences in LiH by a single one-cycle infrared pulse
|
journal
|
May 2017 |
Electronic structure and time-dependent description of rotational predissociation of LiH
|
journal
|
January 2017 |
The multi-configuration electron-nuclear dynamics method applied to LiH
|
journal
|
February 2012 |
Pulse-Train Photoelectron Spectroscopy of Electronic and Nuclear Dynamics in Molecules
|
journal
|
April 2013 |
Electron nuclear dynamics of LiH and HF in an intense laser field
|
journal
|
December 1997 |
Pump and probe ultrafast electron dynamics in LiH: a computational study
|
journal
|
February 2008 |
On the feasibility of an ultrafast purely electronic reorganization in lithium hydride
|
journal
|
September 2007 |
Attosecond pumping of nonstationary electronic states of LiH: Charge shake-up and electron density distortion
|
journal
|
January 2011 |
Laser Steered Ultrafast Quantum Dynamics of Electrons in LiH
|
journal
|
November 2007 |
Localized electron dynamics in attosecond-pulse-excited molecular systems: Probing the time-dependent electron density by sudden photoionization
|
journal
|
November 2012 |
Electronic Dynamics by Ultrafast Pump Photoelectron Detachment Probed by Ionization: A Dynamical Simulation of Negative–Neutral–Positive in LiH –
|
journal
|
April 2014 |
Control of electronic dynamics visualized by angularly resolved photoelectron spectra: A dynamical simulation with an IR pump and XUV attosecond-pulse-train probe
|
journal
|
February 2014 |
Quantum Nuclear Dynamics Pumped and Probed by Ultrafast Polarization Controlled Steering of a Coherent Electronic State in LiH
|
journal
|
March 2016 |
Charge migration in different conformers of glycine: The role of nuclear geometry
|
journal
|
September 2007 |
Attosecond control of the dissociative ionization via electron localization: A comparison between and CO
|
journal
|
December 2009 |
Attosecond Control of Electron Dynamics in Carbon Monoxide
|
journal
|
September 2009 |
Strong-field ionization and high-order-harmonic generation during polyatomic molecular dynamics of N O
|
journal
|
March 2012 |
Time-resolved imaging of purely valence-electron dynamics during a chemical reaction
|
journal
|
April 2011 |
Pump and Probe of Ultrafast Charge Reorganization in Small Peptides: A Computational Study through Sudden Ionizations
|
journal
|
September 2013 |
Revealing Deactivation Pathways Hidden in Time-Resolved Photoelectron Spectra
|
journal
|
October 2016 |
Monitoring non-adiabatic dynamics in CS2 with time- and energy-resolved photoelectron spectra of wavepackets
|
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|
September 2017 |
Molecular above-threshold-ionization spectra: The effect of moving nuclei
|
journal
|
January 2003 |
Attosecond photoionization of a coherent superposition of bound and dissociative molecular states: effect of nuclear motion
|
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|
June 2009 |
Dynamic nuclear interference structures in the Coulomb explosion spectra of a hydrogen molecule in intense laser fields: Reexamination of molecular enhanced ionization
|
journal
|
July 2007 |
Monitoring attosecond dynamics of coherent electron-nuclear wave packets by molecular high-order-harmonic generation
|
journal
|
August 2011 |
Quantum mechanical study of electronic and nuclear dynamics of molecules in intense laser fields
|
journal
|
September 2004 |
Quantum dynamics, isotope effects, and power spectra of and excited to the continuum by strong one-cycle laser pulses: Three-dimensional non-Born-Oppenheimer simulations
|
journal
|
December 2018 |
Controlling and Dissociation with the Carrier-Envelope Phase Difference of an Intense Ultrashort Laser Pulse
|
journal
|
October 2004 |
Molecular frame photoelectron angular distributions for H2 ionization by single and trains of attosecond XUV laser pulses
|
journal
|
January 2010 |
Electron kinetic energy distributions from multiphoton ionization of Na2 with femtosecond laser pulses
|
journal
|
September 1993 |
Femtosecond Study of Multiphoton Ionization Processes in K 2 : From Pump−Probe to Control #
|
journal
|
January 1996 |
Theoretical methods for attosecond electron and nuclear dynamics: applications to the H 2 molecule
|
journal
|
October 2015 |
A Review on Ab Initio Approaches for Multielectron Dynamics
|
journal
|
January 2015 |
H 2 : the benchmark molecule for ultrafast science and technologies
|
journal
|
January 2018 |
Time-dependent quantum chemistry of laser driven many-electron molecules
|
journal
|
December 2014 |
Theoretical study of photoionization cross sections for .pi.-electron systems
|
journal
|
December 1970 |
Electron propagator theory calculations of molecular photoionization cross sections: The first-row hydrides
|
journal
|
September 2004 |
High harmonic generation and molecular orbital tomography in multielectron systems
|
journal
|
March 2007 |
Theoretical equations for photoionization cross sections of polyatomic molecules in plane‐wave and orthogonalized plane‐wave approximations
|
journal
|
July 1974 |
A method for two‐electron Gaussian integral and integral derivative evaluation using recurrence relations
|
journal
|
November 1988 |
Efficient recursive computation of molecular integrals over Cartesian Gaussian functions
|
journal
|
April 1986 |
Incorporation of a wave-packet propagation method into the -matrix framework: Investigation of the effects of excited state dynamics on intense-field ionization
|
journal
|
September 2005 |
Detailed comparison of above-threshold-ionization spectra from accurate numerical integrations and high-resolution measurements
|
journal
|
September 1999 |
Above-threshold ionization of helium in the long-wavelength regime: Examining the single-active-electron approximation and the two-electron strong-field approximation
|
journal
|
June 2017 |
Angularly resolved two-photon above-threshold ionization of helium
|
journal
|
February 2019 |
High Harmonic Generation and Molecular Orbital Tomography in Multielectron Systems: Beyond the Single Active Electron Approximation
|
journal
|
September 2006 |
Single-active-electron approximation for describing molecules in ultrashort laser pulses and its application to molecular hydrogen
|
journal
|
June 2008 |
Exchange and polarization effect in high-order harmonic imaging of molecular structures
|
journal
|
October 2010 |
Momentum transfers in correlation-assisted tunneling
|
journal
|
April 2014 |
Cross sections and photoelectron angular distributions in photodetachment from negative ions using equation-of-motion coupled-cluster Dyson orbitals
|
journal
|
September 2009 |
Three-Step Model for High-Harmonic Generation in Many-Electron Systems
|
journal
|
February 2006 |
Keldysh parameter, photoionization adiabaticity, and the tunneling time
|
journal
|
October 2016 |
Tunnel and multiphoton ionization of atoms and ions in a strong laser field (Keldysh theory)
|
journal
|
September 2004 |
Anatomy of strong field ionization
|
journal
|
January 2005 |
Signatures of photon effect in the tunnel regime
|
journal
|
June 2005 |
Strong-field -matrix theory with final-state Coulomb interaction in all orders
|
journal
|
September 2016 |
Effects of Configuration Interaction on Intensities and Phase Shifts
|
journal
|
December 1961 |
Excited-state molecular photoionization dynamics
|
journal
|
August 1995 |
Quantum Coherence in the Time-Resolved Auger Measurement
|
journal
|
December 2003 |
Hybrid-Basis Close-Coupling Interface to Quantum Chemistry Packages for the Treatment of Ionization Problems
|
journal
|
January 2017 |
Photoelectron dynamics of molecules
|
journal
|
July 1984 |
New approach to the one-particle Green's function for finite Fermi systems
|
journal
|
September 1983 |
Autoionization widths by Stieltjes imaging applied to Lanczos pseudospectra
|
journal
|
January 2011 |
Implementation of exterior complex scaling in B-splines to solve atomic and molecular collision problems
|
journal
|
February 2004 |
Convergence of the multicenter B-spline DFT approach for the continuum
|
journal
|
January 2002 |
Total molecular photoionization cross-sections by algebraic diagrammatic construction-Stieltjes-Lanczos method: Benchmark calculations
|
journal
|
October 2013 |
B-spline algebraic diagrammatic construction: Application to photoionization cross-sections and high-order harmonic generation
|
journal
|
October 2014 |
Restricted Correlation Space B-Spline ADC Approach to Molecular Ionization: Theory and Applications to Total Photoionization Cross-Sections
|
journal
|
April 2019 |
Role of electronic correlations in photoionization of NO 2 in the vicinity of the 2 A 1 / 2 B 2 conical intersection
|
journal
|
January 2017 |
Time-dependent analytical -matrix approach for strong-field dynamics. II. Many-electron systems
|
journal
|
October 2012 |
Time-dependent analytical -matrix approach for strong-field dynamics. I. One-electron systems
|
journal
|
October 2012 |
Correlated multielectron systems in strong laser fields: A multiconfiguration time-dependent Hartree-Fock approach
|
journal
|
January 2005 |
Dynamic Exchange in the Strong Field Ionization of Molecules
|
journal
|
September 2015 |
Dynamics of photoionization from molecular electronic wavepacket states in intense pulse laser fields: A nonadiabatic electron wavepacket study
|
journal
|
April 2017 |
Strong-field ionization rates of linear polyenes simulated with time-dependent configuration interaction with an absorbing potential
|
journal
|
November 2014 |
Angular Dependence of Strong Field Ionization of Haloacetylenes HCCX (X = F, Cl, Br, I), Using Time-Dependent Configuration Interaction with an Absorbing Potential
|
journal
|
December 2017 |
Angle dependence of strong-field single and double ionization of carbonyl sulfide
|
journal
|
October 2018 |
Plasma perspective on strong field multiphoton ionization
|
journal
|
September 1993 |
Theory of high-harmonic generation by low-frequency laser fields
|
journal
|
March 1994 |
Rescattering effects in above-threshold ionization: a classical model
|
journal
|
November 1994 |
Strong field approximation for systems with Coulomb interaction
|
journal
|
September 2008 |
Attosecond physics
|
journal
|
February 2009 |
Electron Dynamics and Its Control in Molecules: From Diatomics to Larger Molecular Systems
|
journal
|
January 2012 |
Monitoring conical intersections in the ring opening of furan by attosecond stimulated X-ray Raman spectroscopy
|
journal
|
October 2015 |
Control of Nuclear Dynamics through Conical Intersections and Electronic Coherences
|
journal
|
March 2018 |
Molpro: a general-purpose quantum chemistry program package: Molpro
- Werner, Hans-Joachim; Knowles, Peter J.; Knizia, Gerald
-
Wiley Interdisciplinary Reviews: Computational Molecular Science, Vol. 2, Issue 2
https://doi.org/10.1002/wcms.82
|
journal
|
July 2011 |
An efficient second-order MC SCF method for long configuration expansions
|
journal
|
April 1985 |
A second order multiconfiguration SCF procedure with optimum convergence
|
journal
|
June 1985 |
Photodissociation dynamics of H2S on new coupled ab initio potential energy surfaces
|
journal
|
September 1999 |
Adiabatic and diabatic potential energy surfaces for collisions of CN( X 2 Σ + , A 2 Π) with He
|
journal
|
September 1988 |
MCSCF study of the avoided curve crossing of the two lowest 1 Σ + states of LiF
|
journal
|
May 1981 |
Bonding Features of LiH: A VBSCF Study
|
journal
|
May 1995 |
Studies on electronegativity equalization
|
journal
|
September 1991 |
The meaning and definition of “charge” in molecules
|
journal
|
January 1973 |
Impulsive orientation and alignment of quantum-state-selected NO molecules
|
journal
|
March 2009 |
Laser-Induced Alignment and Orientation of Quantum-State-Selected Large Molecules
|
journal
|
January 2009 |
High-Harmonic Spectroscopy of Oriented OCS Molecules: Emission of Even and Odd Harmonics
|
journal
|
December 2012 |
Propagation Methods for Quantum Molecular Dynamics
|
journal
|
October 1994 |
Probing in Space and Time the Nuclear Motion Driven by Nonequilibrium Electronic Dynamics in Ultrafast Pumped N 2
|
journal
|
March 2016 |
Propagation of nonstationary electronic and nuclear states: attosecond dynamics in LiF
|
journal
|
March 2018 |
Charge migration following ionization in systems with chromophore-donor and amine-acceptor sites
|
journal
|
September 2008 |
Electron dynamics upon ionization: Control of the timescale through chemical substitution and effect of nuclear motion
|
journal
|
March 2015 |
Measurement and laser control of attosecond charge migration in ionized iodoacetylene
|
journal
|
October 2015 |
Exploring coherent electron excitation and migration dynamics by electron diffraction with ultrashort X-ray pulses
|
journal
|
January 2017 |
General Theory of Carrier-Envelope Phase Effects
|
journal
|
November 2007 |
De- and Recoherence of Charge Migration in Ionized Iodoacetylene
|
journal
|
July 2019 |
Attosecond localization of electrons in molecules
|
journal
|
January 2004 |
Time-resolved photoelectron spectroscopy: from wavepackets to observables
|
journal
|
January 2011 |
Ultrafast imaging of laser-controlled non-adiabatic dynamics in NO 2 from time-resolved photoelectron emission
|
journal
|
January 2019 |
Nuclear and electron dynamics from femto- and subfemto-second time-resolved photoelectron angular distributions
|
journal
|
September 2012 |
Coherent imaging of an attosecond electron wave packet
|
journal
|
June 2017 |
Ultrafast nonradiative transition pathways in photo-excited pyrazine: Ab initio analysis of time-resolved vacuum ultraviolet photoelectron spectrum
|
journal
|
November 2018 |
Effect of Nuclear Motion on Molecular High Order Harmonic Pump Probe Spectroscopy
|
journal
|
September 2012 |
Gauge-invariant intense-field approximations to all orders
|
journal
|
March 2007 |
Comparison between length and velocity gauges in quantum simulations of high-order harmonic generation
|
journal
|
June 2010 |
Atoms and molecules in intense laser fields: gauge invariance of theory and models
|
journal
|
July 2013 |
Quantum simulation of high-order harmonic spectra of the hydrogen atom
|
journal
|
February 2009 |
Multiple Ionization Bursts in Laser-Driven Hydrogen Molecular Ion
|
journal
|
November 2010 |
Molecular Electronic-Structure Theory
|
book
|
August 2000 |