Niels Engholm Henriksen

Niels Engholm Henriksen

Associate Professor

DTU CHEMISTRY
Department of Chemistry

Kemi: Faculty
Physical and Biophysical Chemnistry: Theoretical, Computational and Femtochemistry

Technical University of Denmark

Building 206, room 207

2800 Lyngby

Ph.
Fax +45 45 93 48 08
E-mail neh@kemi.dtu.dk
ORCID 0000-0001-7036-2670
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2018
 

Anisotropy enhanced X-ray scattering from solvated transition metal complexes

Biasin, Elisa ; van Driel, Tim B. ; Levi, Gianluca ; Laursen, Mads G. ; Dohn, Asmus O. ; Moltke, Asbjørn ; Vester, Peter ; Hansen, Frederik B. K. ; Kjaer, Kasper S. ; Harlang, Tobias ; Hartsock, Robert ; Christensen, Morten ; Gaffney, Kelly J ; Henriksen, Niels E. ; Møller, Klaus B. ; Haldrup, Kristoffer ; Nielsen, Martin M.
in: Journal of Synchrotron Radiation, vol: 25, issue: 2, pages: 306-315

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1107/S1600577517016964

 

Electronic structure and rovibrational predissociation of the 21Π state in KLi

Jasik, P. ; Kozicki, J. ; Kilich, T. ; Sienkiewicz, J. E. ; Henriksen, N. E.
in: Physical Chemistry Chemical Physics, vol: 20, issue: 27, pages: 18663-18670

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1039/c8cp02551g

  PDF

Hyperfine-Structure-Induced Depolarization of Impulsively Aligned I-2 Molecules

Thomas, Esben Folger ; Sondergaard, Anders A. ; Shepperson, Benjamin ; Henriksen, Niels Engholm ; Stapelfeldt, Henrik
in: Physical Review Letters, vol: 120, issue: 16

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1103/PhysRevLett.120.163202

  PDF

Non-resonant vibrational excitation of HOD and selective bond breaking

Dey, Diptesh ; Henriksen, Niels Engholm
in: Journal of Chemical Physics, vol: 148, issue: 23

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1063/1.5029548

  PDF

Solution Structure and Ultrafast Vibrational Relaxation of the PtPOP Complex Revealed by ΔSCF-QM/MM Direct Dynamics Simulations

Levi, Gianluca ; Pápai, Mátyás Imre ; Henriksen, Niels E. ; Dohn, Asmus O. ; Møller, Klaus B.
in: The Journal of Physical Chemistry Part C, vol: 122, issue: 13, pages: 7100-7119

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: https://doi.org/10.1021/acs.jpcc.8b00301

2017
 

Complete elimination of nonlinear light-matter interactions with broadband ultrafast laser pulses

Shu, Chuan-Cun ; Dong, Daoyi ; Petersen, Ian R. ; Henriksen, Niels Engholm
in: Physical Review A (Atomic, Molecular and Optical Physics), vol: 95, issue: 3

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: https://doi.org/10.1103/PhysRevA.95.033809

  PDF

Electronic structure and time-dependent description of rotational predissociation of LiH

Jasik, P. ; Sienkiewicz, J. E. ; Domsta, J. ; Henriksen, Niels Engholm
in: Physical Chemistry Chemical Physics, vol: 19, issue: 30, pages: 19777-19783

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: https://doi.org/10.1039/c7cp02097j

 

Femtochemistry in the electronic ground state: Dynamic Stark control of vibrational dynamics

Shu, Chuan-Cun ; Thomas, Esben Folger ; Henriksen, Niels Engholm
in: Chemical Physics Letters, vol: 683, pages: 234–239

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: https://doi.org/10.1016/j.cplett.2017.03.006

  PDF

Grid-Based Projector Augmented Wave (GPAW) Implementation of Quantum Mechanics/Molecular Mechanics (QM/MM) Electrostatic Embedding and Application to a Solvated Diplatinum Complex

Dohn, A. O. ; Jónsson, E. Ö. ; Levi, Gianluca ; Mortensen, J. J. ; Lopez-Acevedo, O. ; Thygesen, K. S. ; Jacobsen, K. W. ; Ulstrup, J. ; Henriksen, N. E. ; Møller, K. B. ; Jonsson, H.
in: Journal of Chemical Theory and Computation, vol: 13, issue: 12, pages: 6010–6022

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: https://doi.org/10.1021/acs.jctc.7b00621

 

Phase-Modulated Nonresonant Laser Pulses Can Selectively Convert Enantiomers in a Racemic Mixture

Thomas, Esben Folger ; Henriksen, Niels Engholm
in: Journal of Physical Chemistry Letters, vol: 8, issue: 10, pages: 2212-2219

Type: Journal article (Peer reviewed)

Status: Published     |    Year: 2017     |    DOI: https://doi.org/10.1021/acs.jpclett.7b00662