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Exact Single-Electron Approach to the Dynamics of Molecules in Strong Laser Fields

Physical review letters, 2017-04, Vol.118 (16), p.163202-163202, Article 163202

2017

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Exact Factorization-Based Density Functional Theory of Electrons and Nuclei

Physical review letters, 2016-11, Vol.117 (19), p.193001-193001, Article 193001

2016

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Quantum-Classical Nonadiabatic Dynamics: Coupled- vs Independent-Trajectory Methods

Journal of chemical theory and computation, 2016-05, Vol.12 (5), p.2127-2143

2016

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Coupled-Trajectory Quantum-Classical Approach to Electronic Decoherence in Nonadiabatic Processes

Physical review letters, 2015-08, Vol.115 (7), p.073001-073001, Article 073001

2015

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Laser-Induced Demagnetization at Ultrashort Time Scales: Predictions of TDDFT

Journal of chemical theory and computation, 2015-10, Vol.11 (10), p.4870-4874

2015

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Is the molecular Berry phase an artifact of the Born-Oppenheimer approximation?

Physical review letters, 2014-12, Vol.113 (26), p.263004-263004, Article 263004

2014

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Ocular toxoplasmosis past, present and new aspects of an old disease

Progress in retinal and eye research, 2014-03, Vol.39, p.77-106

2014

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Exact factorization of the time-dependent electron-nuclear wave function

Physical review letters, 2010-09, Vol.105 (12), p.123002-123002, Article 123002

2010

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Correlated electron-nuclear dynamics: exact factorization of the molecular wavefunction

The Journal of chemical physics, 2012-12, Vol.137 (22), p.22A530-22A530

2012

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Understanding band gaps of solids in generalized Kohn–Sham theory

Proceedings of the National Academy of Sciences - PNAS, 2017-03, Vol.114 (11), p.2801-2806

2017

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How to represent crystal structures for machine learning: Towards fast prediction of electronic properties

Physical review. B, Condensed matter and materials physics, 2014-05, Vol.89 (20), Article 205118

2014

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Improved clinical laboratory identification of human pathogenic yeasts by matrix-assisted laser desorption ionization time-of-flight mass spectrometry

Clinical microbiology and infection, 2011-09, Vol.17 (9), p.1359-1365

2011

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The exact forces on classical nuclei in non-adiabatic charge transfer

The Journal of chemical physics, 2015-02, Vol.142 (8), p.084303-084303

2015

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Electronic Flux Density beyond the Born–Oppenheimer Approximation

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2016-05, Vol.120 (19), p.3316-3325

2016

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Electronic non-adiabatic states: towards a density functional theory beyond the Born-Oppenheimer approximation

Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences, 2014-03, Vol.372 (2011), p.20130059-20130059

2014

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