Hu D - Search Results

1

Theoretical analysis of excited states and energy transfer mechanism in conjugated dendrimers.

Huang J, Du L, Hu D, Lan Z. Huang J, et al. Among authors: hu d. J Comput Chem. 2015 Sep 15;36(24):1858. doi: 10.1002/jcc.24005. Epub 2015 Jul 17. J Comput Chem. 2015. PMID: 26255784 No abstract available.

2

Theoretical analysis of excited states and energy transfer mechanism in conjugated dendrimers.

Huang J, Du L, Hu D, Lan Z. Huang J, et al. Among authors: hu d. J Comput Chem. 2015 Jan 30;36(3):151-63. doi: 10.1002/jcc.23778. Epub 2014 Nov 21. J Comput Chem. 2015. PMID: 25413342

3

Erratum: Theoretical analysis of excited states and energy transfer mechanism in conjugated dendrimers.

Huang J, Du L, Hu D, Lan Z. Huang J, et al. Among authors: hu d. J Comput Chem. 2015 Nov 5;36(29):2208. doi: 10.1002/jcc.24041. J Comput Chem. 2015. PMID: 26417838 No abstract available.

4

"Watching" the Dark State in Ultrafast Nonadiabatic Photoisomerization Process of a Light-Driven Molecular Rotary Motor.

Pang X, Cui X, Hu D, Jiang C, Zhao D, Lan Z, Li F. Pang X, et al. Among authors: hu d. J Phys Chem A. 2017 Feb 16;121(6):1240-1249. doi: 10.1021/acs.jpca.6b12253. Epub 2017 Feb 1. J Phys Chem A. 2017. PMID: 28103031

5

Nonadiabatic dynamics simulation of keto isocytosine: a comparison of dynamical performance of different electronic-structure methods.

Hu D, Liu YF, Sobolewski AL, Lan Z. Hu D, et al. Phys Chem Chem Phys. 2017 Jul 26;19(29):19168-19177. doi: 10.1039/c7cp01732d. Phys Chem Chem Phys. 2017. PMID: 28702524

6

Analysis of the Geometrical Evolution in On-the-Fly Surface-Hopping Nonadiabatic Dynamics with Machine Learning Dimensionality Reduction Approaches: Classical Multidimensional Scaling and Isometric Feature Mapping.

Li X, Xie Y, Hu D, Lan Z. Li X, et al. Among authors: hu d. J Chem Theory Comput. 2017 Oct 10;13(10):4611-4623. doi: 10.1021/acs.jctc.7b00394. Epub 2017 Sep 19. J Chem Theory Comput. 2017. PMID: 28862858

7

The behavior of hydroxide and hydronium ions at the hexadecane-water interface studied with second harmonic generation and zeta potential measurements.

Gan W, Wu W, Yang F, Hu D, Fang H, Lan Z, Yuan Q. Gan W, et al. Among authors: hu d. Soft Matter. 2017 Nov 8;13(43):7962-7968. doi: 10.1039/c7sm00813a. Soft Matter. 2017. PMID: 29043365

8

Correction to Analysis of the Geometrical Evolution in On-the-Fly Surface-Hopping Nonadiabatic Dynamics with Machine Learning Dimensionality Reduction Approaches: Classical Multidimensional Scaling and Isometric Feature Mapping.

Li X, Xie Y, Hu D, Lan Z. Li X, et al. Among authors: hu d. J Chem Theory Comput. 2017 Dec 12;13(12):6434. doi: 10.1021/acs.jctc.7b01155. Epub 2017 Nov 21. J Chem Theory Comput. 2017. PMID: 29160069 No abstract available.

9

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. Hu D, et al. J Phys Chem Lett. 2018 Jun 7;9(11):2725-2732. doi: 10.1021/acs.jpclett.8b00684. Epub 2018 May 10. J Phys Chem Lett. 2018. PMID: 29732893

10

Ultrafast unidirectional chiral rotation in the Z-E photoisomerization of two azoheteroarene photoswitches.

Pang X , Jiang C , Qi Y , Yuan L , Hu D , Zhang X , Zhao D , Wang D , Lan Z , Li F . Pang X , et al. Among authors: hu d. Phys Chem Chem Phys. 2018 Oct 17;20(40):25910-25917. doi: 10.1039/c8cp04762f. Phys Chem Chem Phys. 2018. PMID: 30289421

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