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Wolfgang Domcke

technical university of munich

91H-index
525Paper Count
3.1WCitation Count
Published Papers 94
Publication Date
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Substitution Effects on the S1–T1 Energy Gap and the S1–S0 Oscillator Strength in Pentaazaphenalene Derivatives: A Computational Study
errThe Journal of Physical Chemistry A
IF2.8
err2026-06-22
err0
PREAI
errMagdalena W. Duszka; Wolfgang Domcke; Andrzej L. Sobolewski
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WaveMixings.jl: A Julia Package for Computing Time-Resolved Nonlinear Electronic Spectra from on-the-Fly Quasi-Classical Trajectories
errJournal of Chemical Theory and Computation
IF5.5
err2026-01-22
err0
PREAI
errLuis Vasquez; Maxim F. Gelin; Sebastian Pios; Lipeng Chen; Zhenggang Lan; Wolfgang Domcke
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Computational Design of B,N-Substituted Graphene Ribbons Exhibiting S1 and T1 States with Near-Degeneracy and High Oscillator Strengths
errCHEMPHYSCHEM
IF2.2
err2025-09-01
err0
PREAI
errDuszka, Magdalena W.; Domcke, Wolfgang; Sobolewski, Andrzej L.
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Computation of Time-Resolved Nonlinear Electronic Spectra From Classical Trajectories
errWILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE
IF27
err2025-05-20
err0
errOAAI
errMaxim F. Gelin; Zhenggang Lan; Nađa Došlić; Wolfgang Domcke
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Imaging the Photochemistry of the Hydrogen-Bonded Heptazine-Water Complex with Femtosecond Time-Resolved Spectroscopy: A Computational Study
errJOURNAL OF PHYSICAL CHEMISTRY A
IF2.8
err2025-02-20
err0
errOAAI
errPios, Sebastian V.; Gelin, Maxim F.; Domcke, Wolfgang
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Quantum dynamics with ab initio potentials
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-08-25
err4
PREAI
errGuo, Hua; Worth, Graham; Domcke, Wolfgang
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Combined Surface-Hopping, Dyson Orbital, and B-Spline Approach for the Computation of Time-Resolved Photoelectron Spectroscopy Signals: The Internal Conversion in Pyrazine
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-07-16
err20
PREAI
errPitesa, Tomislav; Sapunar, Marin; Ponzi, Aurora; Gelin, Maxim F.; Doslic, Nada; Domcke, Wolfgang; Decleva, Piero
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Ab Initio Surface-Hopping Simulation of Femtosecond Transient-Absorption Pump-Probe Signals of Nonadiabatic Excited-State Dynamics Using the Doorway-Window Representation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-03-23
err28
PREAI
errGelin, Maxim F.; Huang, Xiang; Xie, Weiwei; Chen, Lipeng; Doslic, Nada; Domcke, Wolfgang
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Strong static and dynamic Jahn-Teller and pseudo-Jahn-Teller effects in niobium tetrafluoride
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-03-22
err5
PREAI
errVasilyev, Oleg A.; Nandipati, Krishna R.; Navarkin, Ilya S.; Solomonik, Victor G.; Domcke, Wolfgang
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Multi-faceted spectroscopic mapping of ultrafast nonadiabatic dynamics near conical intersections: A computational study
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-11-05
err33
PREAI
errSun, Kewei; Xie, Weiwei; Chen, Lipeng; Domcke, Wolfgang; Gelin, Maxim F.
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Photooxidation of water with heptazine-based molecular photocatalysts: Insights from spectroscopy and computational chemistry
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-09-08
err21
errOAAI
errDomcke, Wolfgang; Sobolewski, Andrzej L.; Schlenker, Cody W.
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Tracking both ultrafast electrons and nuclei
errSCIENCE
IF45.8
err2020-05-22
err3
PREAI
errDomcke, Wolfgang; Sobolewski, Andrzej L.
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First-principles study of large-amplitude dynamic Jahn-Teller effects in vanadium tetrafluoride
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-03-03
err7
PREAI
errNandipati, K. R.; Vasilyev, O. A.; Navarkin, I. S.; Solomonik, V. G.; Domcke, W.
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Control of Excited-State Proton-Coupled Electron Transfer by Ultrafast Pump-Push-Probe Spectroscopy in Heptazine-Phenol Complexes: Implications for Photochemical Water Oxidation
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-03-02
err21
errOAAI
errCorp, Kathryn L.; Rabe, Emily J.; Huang, Xiang; Ehrmaier, Johannes; Kaiser, Mitchell E.; Sobolewski, Andrzej L.; Domcke, Wolfgang; Schlenker, Cody W.
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Barrierless Heptazine-Driven Excited State Proton-Coupled Electron Transfer: Implications for Controlling Photochemistry of Carbon Nitrides and Aza-Arenes
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2019-11-18
err26
PREAI
errRabe, Emily J.; Corp, Kathryn L.; Huang, Xiang; Ehrmaier, Johannes; Flores, Ryan G.; Estes, Sabrina L.; Sobolewski, Andrzej L.; Domcke, Wolfgang; Schlenker, Cody W.
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Spin-orbit vibronic coupling in π4 states of linear triatomic molecules
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-10-01
err1
PREAI
errPoluyanov, Leonid, V; Domcke, Wolfgang; Mishra, Sabyashachi
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Orientational relaxation of a quantum linear rotor in a dissipative environment: Simulations with the hierarchical equations-of-motion method
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-07-15
err5
PREAI
errChen, Lipeng; Gelin, Maxim F.; Domcke, Wolfgang
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Analysis of transient-absorption pump-probe signals of nonadiabatic dissipative systems: Ideal and real spectra
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-05-22
err21
PREAI
errPalacino-Gonzalez, Elisa; Gelin, Maxim F.; Domcke, Wolfgang
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Assessing the performance of trajectory surface hopping methods: Ultrafast internal conversion in pyrazine
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-04-19
err53
errOAAI
errXie, Weiwei; Sapunar, Marin; Doslic, Nada; Sala, Matthieu; Domcke, Wolfgang
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Monitoring of Nonadiabatic Effects in Individual Chromophores by Femtosecond Double-Pump Single-Molecule Spectroscopy: A Model Study
errMOLECULES
IF4.6
err2019-01-09
err6
errOAAI
errGelin, Maxim F.; Palacino-Gonzalez, Elisa; Chen, Lipeng; Domcke, Wolfgang
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Research Directions

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Co-authors
Cooperation Journals
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Michaël Grätzel
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James R. Durrant
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孙立成 (Licheng Sun)
H-index: 134 · Papers: 1.2K
A
Andrew I. Cooper
H-index: 134 · Papers: 833
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