Jiri Vanicek, Ph.D. - Publications

Affiliations: 
Chemistry École Polytechnique Fédérale de Lausanne, Lausanne, Switzerland 
Area:
Theoretical chemical physics
Website:
http://lcpt.epfl.ch

21 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Choi S, Vaníček J. Which form of the molecular Hamiltonian is the most suitable for simulating the nonadiabatic quantum dynamics at a conical intersection? The Journal of Chemical Physics. 153: 211101. PMID 33291891 DOI: 10.1063/5.0033410  0.311
2019 Vaillant CL, Thapa MJ, Vaniček J, Richardson JO. Publisher's Note: "Semiclassical analysis of the quantum instanton approximation" [J. Chem. Phys. 151, 144111 (2019)]. The Journal of Chemical Physics. 151: 189902. PMID 31731840 DOI: 10.1063/1.5133748  0.304
2019 Vaillant CL, Thapa MJ, Vaníček J, Richardson JO. Semiclassical analysis of the quantum instanton approximation. The Journal of Chemical Physics. 151: 144111. PMID 31615229 DOI: 10.1063/1.5123800  0.348
2018 Begušić T, Roulet J, Vaníček J. On-the-fly semiclassical evaluation of time-resolved electronic spectra. The Journal of Chemical Physics. 149: 244115. PMID 30599739 DOI: 10.1063/1.5054586  0.329
2017 Bircher MP, Liberatore E, Browning NJ, Brickel S, Hofmann C, Patoz A, Unke OT, Zimmermann T, Chergui M, Hamm P, Keller U, Meuwly M, Woerner HJ, Vaníček J, Rothlisberger U. Nonadiabatic effects in electronic and nuclear dynamics. Structural Dynamics (Melville, N.Y.). 4: 061510. PMID 29376108 DOI: 10.1063/1.4996816  0.374
2017 Karandashev K, Xu ZH, Meuwly M, Vaníček J, Richardson JO. Kinetic isotope effects and how to describe them. Structural Dynamics (Melville, N.Y.). 4: 061501. PMID 29282447 DOI: 10.1063/1.4996339  0.328
2017 Vaníček J. Several Semiclassical Approaches to Time-resolved Spectroscopy. Chimia. 71: 283-287. PMID 28576154 DOI: 10.2533/Chimia.2017.283  0.361
2016 Vaníček J, Cohen D. Path integral approach to the quantum fidelity amplitude. Philosophical Transactions. Series a, Mathematical, Physical, and Engineering Sciences. 374. PMID 27140973 DOI: 10.1098/Rsta.2015.0164  0.433
2015 Karandashev K, Vaníček J. Accelerating quantum instanton calculations of the kinetic isotope effects. The Journal of Chemical Physics. 143: 194104. PMID 26590524 DOI: 10.1063/1.4935701  0.34
2011 Vanícek J. Beyond transition state theory: accurate description of nuclear quantum effects on the rate and equilibrium constants of chemical reactions using Feynman path integrals. Chimia. 65: 715-9. PMID 22026186 DOI: 10.2533/Chimia.2011.715  0.421
2011 Wehrle M, Sulc M, Vanícek J. Accelerating calculations of ultrafast time-resolved electronic spectra with efficient quantum dynamics methods. Chimia. 65: 334-8. PMID 21744688 DOI: 10.2533/Chimia.2011.334  0.419
2010 Zimmermann T, Vanícek J. Communications: Evaluation of the nondiabaticity of quantum molecular dynamics with the dephasing representation of quantum fidelity. The Journal of Chemical Physics. 132: 241101. PMID 20590170 DOI: 10.1063/1.3451266  0.326
2010 Buchowiecki M, Vanícek J. Direct evaluation of the temperature dependence of the rate constant based on the quantum instanton approximation. The Journal of Chemical Physics. 132: 194106. PMID 20499950 DOI: 10.1063/1.3425617  0.42
2009 Li B, Mollica C, Vanícek J. Efficient evaluation of accuracy of molecular quantum dynamics using dephasing representation. The Journal of Chemical Physics. 131: 041101. PMID 19655830 DOI: 10.1063/1.3187240  0.327
2009 Zimmermann T, Vanícek J. Path integral evaluation of equilibrium isotope effects. The Journal of Chemical Physics. 131: 024111. PMID 19603974 DOI: 10.1063/1.3167353  0.41
2006 Vanícek J. Dephasing representation of quantum fidelity for general pure and mixed states. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 73: 046204. PMID 16711914 DOI: 10.1103/Physreve.73.046204  0.414
2005 Vanícek J, Miller WH, Castillo JF, Aoiz FJ. Quantum-instanton evaluation of the kinetic isotope effects. The Journal of Chemical Physics. 123: 054108. PMID 16108632 DOI: 10.1063/1.1946740  0.521
2004 Vanícek J. Dephasing representation: Employing the shadowing theorem to calculate quantum correlation functions. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 70: 055201. PMID 15600677 DOI: 10.1103/Physreve.70.055201  0.445
2003 Vanícek J, Heller EJ. Semiclassical evaluation of quantum fidelity. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 68: 056208. PMID 14682872 DOI: 10.1103/Physreve.68.056208  0.554
2003 Vanícek J, Heller EJ. Uniform semiclassical wave function for coherent two-dimensional electron flow. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 67: 016211. PMID 12636589 DOI: 10.1103/Physreve.67.016211  0.494
2001 Vanícek J, Heller EJ. Replacement manifolds: a method to uniformize semiclassical wave functions. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 64: 026215. PMID 11497685 DOI: 10.1103/Physreve.64.026215  0.492
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