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 *

166 related articles for article (PubMed ID: 36856588)

  • 1. Semiclassical Dynamics on Machine-Learned Coupled Multireference Potential Energy Surfaces: Application to the Photodissociation of the Simplest Criegee Intermediate.
    Sit MK; Das S; Samanta K
    J Phys Chem A; 2023 Mar; 127(10):2376-2387. PubMed ID: 36856588
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Machine Learning-Assisted Mixed Quantum-Classical Dynamics without Explicit Nonadiabatic Coupling: Application to the Photodissociation of Peroxynitric Acid.
    Sit MK; Das S; Samanta K
    J Phys Chem A; 2024 Sep; 128(38):8244-8253. PubMed ID: 39283987
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Trajectory surface hopping study of propane photodissociation dynamics at 157 nm.
    Rauta AK; Maiti B
    J Chem Phys; 2018 Jul; 149(4):044308. PubMed ID: 30068164
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Comparing the Excited State Dynamics of CH
    Antwi E; Ratliff JM; Ashfold MNR; Karsili TNV
    J Phys Chem A; 2022 Sep; 126(36):6236-6243. PubMed ID: 36067494
    [No Abstract]   [Full Text] [Related]  

  • 5. Quantum dynamical investigation of the simplest Criegee intermediate CH2OO and its O-O photodissociation channels.
    Samanta K; Beames JM; Lester MI; Subotnik JE
    J Chem Phys; 2014 Oct; 141(13):134303. PubMed ID: 25296802
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Inclusion of Machine Learning Kernel Ridge Regression Potential Energy Surfaces in On-the-Fly Nonadiabatic Molecular Dynamics Simulation.
    Hu D; Xie Y; Li X; Li L; Lan Z
    J Phys Chem Lett; 2018 Jun; 9(11):2725-2732. PubMed ID: 29732893
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Fully quantal description of combined internal conversion and intersystem crossing processes in the smallest Criegee intermediate CH
    Nikoobakht B; Köppel H
    Phys Chem Chem Phys; 2024 Sep; 26(37):24591-24606. PubMed ID: 39269221
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Photodissociation Dynamics of CH
    Esposito VJ; Liu T; Wang G; Caracciolo A; Vansco MF; Marchetti B; Karsili TNV; Lester MI
    J Phys Chem A; 2021 Aug; 125(30):6571-6579. PubMed ID: 34314179
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Velocity map imaging of O-atom products from UV photodissociation of the CH2OO Criegee intermediate.
    Li H; Fang Y; Beames JM; Lester MI
    J Chem Phys; 2015 Jun; 142(21):214312. PubMed ID: 26049501
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Nonadiabatic excited-state molecular dynamics: modeling photophysics in organic conjugated materials.
    Nelson T; Fernandez-Alberti S; Roitberg AE; Tretiak S
    Acc Chem Res; 2014 Apr; 47(4):1155-64. PubMed ID: 24673100
    [TBL] [Abstract][Full Text] [Related]  

  • 11. On the inclusion of the diagonal Born-Oppenheimer correction in surface hopping methods.
    Gherib R; Ye L; Ryabinkin IG; Izmaylov AF
    J Chem Phys; 2016 Apr; 144(15):154103. PubMed ID: 27389205
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Photodissociation Dynamics of Methyl Hydroperoxide at 193 nm: A Trajectory Surface-Hopping Study.
    Mahata P; Maiti B
    J Phys Chem A; 2021 Dec; 125(48):10321-10329. PubMed ID: 34807597
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Adiabatic and nonadiabatic dissociation of ethyl radical.
    Hostettler JM; Bach A; Chen P
    J Chem Phys; 2009 Jan; 130(3):034303. PubMed ID: 19173517
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Nonadiabatic quantum reactive scattering of the OH(A  2Σ+) + D2.
    Zhang PY; Lu RF; Chu TS; Han KL
    J Chem Phys; 2010 Nov; 133(17):174316. PubMed ID: 21054041
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Nonadiabatic Derivative Couplings Calculated Using Information of Potential Energy Surfaces without Wavefunctions: Ab Initio and Machine Learning Implementations.
    Chen WK; Wang SR; Liu XY; Fang WH; Cui G
    Molecules; 2023 May; 28(10):. PubMed ID: 37241962
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Communication: Ultraviolet photodissociation dynamics of the simplest Criegee intermediate CH2OO.
    Lehman JH; Li H; Beames JM; Lester MI
    J Chem Phys; 2013 Oct; 139(14):141103. PubMed ID: 24116596
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Prompt release of O
    Vansco MF; Li H; Lester MI
    J Chem Phys; 2017 Jul; 147(1):013907. PubMed ID: 28688384
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Born-Oppenheimer and Renner-Teller Quantum Dynamics of CH(X(2)Π) + D((2)S) Reactions on Three CHD Potential Surfaces.
    Gamallo P; Akpinar S; Defazio P; Petrongolo C
    J Phys Chem A; 2015 Nov; 119(46):11254-64. PubMed ID: 26522748
    [TBL] [Abstract][Full Text] [Related]  

  • 19. State-to-state vacuum ultraviolet photodissociation study of CO2 on the formation of state-correlated CO(X(1)Σ(+); v) with O((1)D) and O((1)S) photoproducts at 11.95-12.22 eV.
    Lu Z; Chang YC; Benitez Y; Luo Z; Houria AB; Ayari T; Al Mogren MM; Hochlaf M; Jackson WM; Ng CY
    Phys Chem Chem Phys; 2015 May; 17(17):11752-62. PubMed ID: 25868654
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Study of the C(3P) + OH(X2Pi) --> CO(a3Pi) + H(2S) reaction: fully global ab initio potential energy surfaces of the 12A'' and 14A'' excited states and non adiabatic couplings.
    Zanchet A; Bussery-Honvault B; Jorfi M; Honvault P
    Phys Chem Chem Phys; 2009 Aug; 11(29):6182-91. PubMed ID: 19606328
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.