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Calculating two-dimensional spectra with the mixed quantum-classical Ehrenfest method.
J Phys Chem A. 2013 Jul 25;117(29):5970-80. doi: 10.1021/jp311668r. Epub 2013 Feb 15.
J Phys Chem A. 2013.
PMID: 23360103
Surface hopping modeling of two-dimensional spectra.
Tempelaar R, van der Vegte CP, Knoester J, Jansen TL.
Tempelaar R, et al. Among authors: van der vegte cp.
J Chem Phys. 2013 Apr 28;138(16):164106. doi: 10.1063/1.4801519.
J Chem Phys. 2013.
PMID: 23635110
Free article.
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OH-stretching in synthetic hydrogen-bonded chains.
van der Vegte CP, Knop S, Vöhringer P, Knoester J, Jansen TL.
van der Vegte CP, et al.
J Phys Chem B. 2014 Jun 12;118(23):6256-64. doi: 10.1021/jp504267h. Epub 2014 May 28.
J Phys Chem B. 2014.
PMID: 24820546
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Atomistic modeling of two-dimensional electronic spectra and excited-state dynamics for a Light Harvesting 2 complex.
van der Vegte CP, Prajapati JD, Kleinekathöfer U, Knoester J, Jansen TL.
van der Vegte CP, et al.
J Phys Chem B. 2015 Jan 29;119(4):1302-13. doi: 10.1021/jp509247p. Epub 2015 Jan 16.
J Phys Chem B. 2015.
PMID: 25554919
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Suppressing sampling noise in linear and two-dimensional spectral simulations.
Kruiger JF, van der Vegte CP, Jansen TL.
Kruiger JF, et al. Among authors: van der vegte cp.
J Chem Phys. 2015 Feb 7;142(5):054201. doi: 10.1063/1.4907277.
J Chem Phys. 2015.
PMID: 25662638
Free article.
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