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 *

284 related articles for article (PubMed ID: 24320364)

  • 1. Can we derive Tully's surface-hopping algorithm from the semiclassical quantum Liouville equation? Almost, but only with decoherence.
    Subotnik JE; Ouyang W; Landry BR
    J Chem Phys; 2013 Dec; 139(21):214107. PubMed ID: 24320364
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Estimating the entropy and quantifying the impurity of a swarm of surface-hopping trajectories: a new perspective on decoherence.
    Ouyang W; Subotnik JE
    J Chem Phys; 2014 May; 140(20):204102. PubMed ID: 24880261
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Communication: The correct interpretation of surface hopping trajectories: how to calculate electronic properties.
    Landry BR; Falk MJ; Subotnik JE
    J Chem Phys; 2013 Dec; 139(21):211101. PubMed ID: 24320356
    [TBL] [Abstract][Full Text] [Related]  

  • 4. An efficient solution to the decoherence enhanced trivial crossing problem in surface hopping.
    Bai X; Qiu J; Wang L
    J Chem Phys; 2018 Mar; 148(10):104106. PubMed ID: 29544303
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Revisiting the Recoherence Problem in the Fewest Switches Surface Hopping Algorithm.
    Miao G; Subotnik J
    J Phys Chem A; 2019 Jul; 123(26):5428-5435. PubMed ID: 31180218
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Fewest-switches surface hopping and decoherence in multiple dimensions.
    Subotnik JE
    J Phys Chem A; 2011 Nov; 115(44):12083-96. PubMed ID: 21995423
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A mapping approach to surface hopping.
    Mannouch JR; Richardson JO
    J Chem Phys; 2023 Mar; 158(10):104111. PubMed ID: 36922129
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Decoherence and surface hopping: when can averaging over initial conditions help capture the effects of wave packet separation?
    Subotnik JE; Shenvi N
    J Chem Phys; 2011 Jun; 134(24):244114. PubMed ID: 21721619
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Simultaneous-trajectory surface hopping: a parameter-free algorithm for implementing decoherence in nonadiabatic dynamics.
    Shenvi N; Subotnik JE; Yang W
    J Chem Phys; 2011 Apr; 134(14):144102. PubMed ID: 21495737
    [TBL] [Abstract][Full Text] [Related]  

  • 10. A new approach to decoherence and momentum rescaling in the surface hopping algorithm.
    Subotnik JE; Shenvi N
    J Chem Phys; 2011 Jan; 134(2):024105. PubMed ID: 21241078
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Ring Polymer Surface Hopping: Incorporating Nuclear Quantum Effects into Nonadiabatic Molecular Dynamics Simulations.
    Shakib FA; Huo P
    J Phys Chem Lett; 2017 Jul; 8(13):3073-3080. PubMed ID: 28629220
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Critical appraisal of the fewest switches algorithm for surface hopping.
    Granucci G; Persico M
    J Chem Phys; 2007 Apr; 126(13):134114. PubMed ID: 17430023
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Surface hopping with a manifold of electronic states. I. Incorporating surface-leaking to capture lifetimes.
    Ouyang W; Dou W; Subotnik JE
    J Chem Phys; 2015 Feb; 142(8):084109. PubMed ID: 25725714
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Non-Hermitian surface hopping.
    Gao X; Thiel W
    Phys Rev E; 2017 Jan; 95(1-1):013308. PubMed ID: 28208473
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Mean-field dynamics with stochastic decoherence (MF-SD): a new algorithm for nonadiabatic mixed quantum/classical molecular-dynamics simulations with nuclear-induced decoherence.
    Bedard-Hearn MJ; Larsen RE; Schwartz BJ
    J Chem Phys; 2005 Dec; 123(23):234106. PubMed ID: 16392913
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Exploring the role of decoherence in condensed-phase nonadiabatic dynamics: a comparison of different mixed quantum/classical simulation algorithms for the excited hydrated electron.
    Larsen RE; Bedard-Hearn MJ; Schwartz BJ
    J Phys Chem B; 2006 Oct; 110(40):20055-66. PubMed ID: 17020394
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Fewest switches adiabatic surface hopping as applied to vibrational energy relaxation.
    Käb G
    J Phys Chem A; 2006 Mar; 110(9):3197-215. PubMed ID: 16509644
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Surface Hopping without Momentum Jumps: A Quantum-Trajectory-Based Approach to Nonadiabatic Dynamics.
    Martens CC
    J Phys Chem A; 2019 Feb; 123(5):1110-1128. PubMed ID: 30632757
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Semiclassical description of nuclear dynamics moving through complex-valued single avoided crossings of two electronic states.
    Wu Y; Subotnik JE
    J Chem Phys; 2021 Jun; 154(23):234101. PubMed ID: 34241259
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Recent Progress in Surface Hopping: 2011-2015.
    Wang L; Akimov A; Prezhdo OV
    J Phys Chem Lett; 2016 Jun; 7(11):2100-12. PubMed ID: 27171314
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 15.