These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

197 related articles for article (PubMed ID: 25338882)

  • 1. Calculating time-resolved differential absorbance spectra for ultrafast pump-probe experiments with surface hopping trajectories.
    Petit AS; Subotnik JE
    J Chem Phys; 2014 Oct; 141(15):154108. PubMed ID: 25338882
    [TBL] [Abstract][Full Text] [Related]  

  • 2. How to calculate linear absorption spectra with lifetime broadening using fewest switches surface hopping trajectories: a simple generalization of ground-state Kubo theory.
    Petit AS; Subotnik JE
    J Chem Phys; 2014 Jul; 141(1):014107. PubMed ID: 25005277
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Appraisal of Surface Hopping as a Tool for Modeling Condensed Phase Linear Absorption Spectra.
    Petit AS; Subotnik JE
    J Chem Theory Comput; 2015 Sep; 11(9):4328-41. PubMed ID: 26575927
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Efficient on-the-fly ab initio semiclassical method for computing time-resolved nonadiabatic electronic spectra with surface hopping or Ehrenfest dynamics.
    Zimmermann T; Vaníček J
    J Chem Phys; 2014 Oct; 141(13):134102. PubMed ID: 25296779
    [TBL] [Abstract][Full Text] [Related]  

  • 5. A benchmark study of different methods for calculating one- and two-dimensional optical spectra.
    McRobbie PL; Geva E
    J Phys Chem A; 2009 Oct; 113(39):10425-34. PubMed ID: 19775171
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Ab initio nonadiabatic dynamics study of ultrafast radiationless decay over conical intersections illustrated on the Na3F cluster.
    Mitrić R; Bonacić-Koutecký V; Pittner J; Lischka H
    J Chem Phys; 2006 Jul; 125(2):24303. PubMed ID: 16848580
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A mixed quantum-classical molecular dynamics study of the hydroxyl stretch in methanol/carbon tetrachloride mixtures III: nonequilibrium hydrogen-bond dynamics and infrared pump-probe spectra.
    Kwac K; Geva E
    J Phys Chem B; 2013 Jun; 117(25):7737-49. PubMed ID: 23713405
    [TBL] [Abstract][Full Text] [Related]  

  • 8. A comparison between different semiclassical approximations for optical response functions in nonpolar liquid solution. II. The signature of excited state dynamics on two-dimensional spectra.
    Shi Q; Geva E
    J Chem Phys; 2008 Sep; 129(12):124505. PubMed ID: 19045034
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Two-dimensional electronic spectroscopy of beta-carotene.
    Christensson N; Milota F; Nemeth A; Sperling J; Kauffmann HF; Pullerits T; Hauer J
    J Phys Chem B; 2009 Dec; 113(51):16409-19. PubMed ID: 19954155
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Nonadiabatic nuclear dynamics of the ammonia cation studied by surface hopping classical trajectory calculations.
    Belyaev AK; Domcke W; Lasser C; Trigila G
    J Chem Phys; 2015 Mar; 142(10):104307. PubMed ID: 25770540
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Signatures of nonequilibrium solvation dynamics on multidimensional spectra.
    McRobbie PL; Hanna G; Shi Q; Geva E
    Acc Chem Res; 2009 Sep; 42(9):1299-309. PubMed ID: 19552404
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Time- and frequency-resolved fluorescence spectra of nonadiabatic dissipative systems: what photons can tell us.
    Egorova D; Gelin MF; Domcke W
    J Chem Phys; 2005 Apr; 122(13):134504. PubMed ID: 15847478
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Nonadiabatic molecular dynamics simulations: synergies between theory and experiments.
    Tavernelli I
    Acc Chem Res; 2015 Mar; 48(3):792-800. PubMed ID: 25647401
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Vibrationally resolved optical spectra and ultrafast electronic relaxation dynamics of diamantane.
    Röhr MI; Mitrić R; Petersen J
    Phys Chem Chem Phys; 2016 Mar; 18(12):8701-9. PubMed ID: 26954327
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Effects of Electronic-State-Dependent Solute Polarizability: Application to Solute-Pump/Solvent-Probe Spectra.
    Sun X; Ladanyi BM; Stratt RM
    J Phys Chem B; 2015 Jul; 119(29):9129-39. PubMed ID: 25299940
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Nonequilibrium H/D isotope effects from trajectory-based nonadiabatic dynamics.
    Spörkel L; Cui G; Koslowski A; Thiel W
    J Phys Chem A; 2014 Jan; 118(1):152-7. PubMed ID: 24328181
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Field-induced surface hopping method for probing transition state nonadiabatic dynamics of Ag3.
    Mitrić R; Petersen J; Wohlgemuth M; Werner U; Bonačić-Koutecký V
    Phys Chem Chem Phys; 2011 May; 13(19):8690-6. PubMed ID: 21483897
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Multidimensional spectra via the mixed quantum-classical Liouville method: signatures of nonequilibrium dynamics.
    Hanna G; Geva E
    J Phys Chem B; 2009 Jul; 113(27):9278-88. PubMed ID: 19530666
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Ab Initio Surface-Hopping Simulation of Femtosecond Transient-Absorption Pump-Probe Signals of Nonadiabatic Excited-State Dynamics Using the Doorway-Window Representation.
    Gelin MF; Huang X; Xie W; Chen L; Došlić NA; Domcke W
    J Chem Theory Comput; 2021 Apr; 17(4):2394-2408. PubMed ID: 33755464
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Nonadiabatic molecular dynamics simulations of correlated electrons in solution. 1. Full configuration interaction (CI) excited-state relaxation dynamics of hydrated dielectrons.
    Larsen RE; Schwartz BJ
    J Phys Chem B; 2006 May; 110(19):9681-91. PubMed ID: 16686519
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 10.