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Theoretical and Computational Chemistry

Working Paper

Diboron- and Diaza-Doped Anthracenes and Phenanthrenes: Their Electronic Structures for Being Singlet Fission Chromophores

Ekadashi Pradhan, Tao Zeng

Version 1 posted 29 July 2020

307

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Inorganic Chemistry

Working Paper

Mechanistic Study of Nucleation Enhancement in Atomic Layer Deposition by Pre-Treatment with Small Organometallic Molecules

Camila de Paula, Nathaniel Richey, Li Zeng, Stacey Bent

Version 2 posted 11 September 2019

1,412

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1

Citations

Theoretical and Computational Chemistry

Working Paper

ReacNetGenerator: an Automatic Reaction Network Generator for Reactive Molecular Dynamic Simulations

Jinzhe Zeng, Liqun Cao, John ZH Zhang, Chih-Hao Chin, Tong Zhu

Version 3 posted 19 August 2019

1,773

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Earth, Space, and Environmental Chemistry

Working Paper

One-Pot Reduction of Metal Oxides/Salts with Carbohydrate Biomass Under Mild Hydrothermal Conditions

Yangyuan Zhou, Li Wang, Guodong Yin, Guodong Yao, Xu Zeng, Jianfu Zhao

Version 1 posted 05 April 2021

343

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Earth, Space, and Environmental Chemistry

Working Paper

Impact of Surface Hydrophobicity and Salinity on the Adsorption of Humic Acids

Duowei Yuan, Ken Cadien, Qi Liu, Hongbo Zeng

Version 1 posted 03 May 2019

695

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Theoretical and Computational Chemistry

Working Paper

A Unified Hamiltonian Formalism of Jahn-Teller and Pseudo-Jahn-Teller Problems in Axial Symmetries

James Brown, Robert Lang, Tao Zeng

Version 1 posted 03 May 2021

219

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Materials Science

Working Paper

Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modelling

Barbara Souza, Lorenzo Dona, Kirill Titov, Paolo Bruzzese, Zhixin Zeng, Yang Zhang, Arun Babal, Annika Moslein, Mark Frogley, Magda Wolna, Gianfelice Cinque, Bartolomeo Civalleri, Jin-Chong Tan

Version 1 posted 16 October 2019

672

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Physical Chemistry

Working Paper

NaI Revisited: Theoretical Investigation of Predissociation via Ultrafast XUV Transient Absorption Spectroscopy

Yuki Kobayashi, Tao Zeng, Daniel Neumark, Stephen Leone

Version 1 posted 16 September 2019

666

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Theoretical and Computational Chemistry

Working Paper

Combustion Driven by Fragment-based Ab Initio Molecular Dynamics Simulation

Liqun Cao, Jinzhe Zeng, Mingyuan Xu, Chih-Hao Chin, Tong Zhu, John ZH Zhang

Version 1 posted 31 December 2019

505

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Physical Chemistry

Working Paper

How to Manipulate Through-Space Conjugation and Clusterolumi-nescence of Simple AIEgens with Isolated Phenyl Rings?

Jianyu Zhang, lianrui hu, Kaihua Zhang, Junkai LIU, Xingguang Li, Haoran Wang, Zhaoyu Wang, Herman H.-Y. Sung, ian duncan williams, Zebing Zeng, Jacky W. Y. Lam, Haoke Zhang, Ben Zhong Tang

Version 1 posted 13 April 2021

343

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Refine Search

119 results in An Zeng in Authors: An Zeng

Diboron- and Diaza-Doped Anthracenes and Phenanthrenes: Their Electronic Structures for Being Singlet Fission Chromophores

Mechanistic Study of Nucleation Enhancement in Atomic Layer Deposition by Pre-Treatment with Small Organometallic Molecules

ReacNetGenerator: an Automatic Reaction Network Generator for Reactive Molecular Dynamic Simulations

One-Pot Reduction of Metal Oxides/Salts with Carbohydrate Biomass Under Mild Hydrothermal Conditions

Impact of Surface Hydrophobicity and Salinity on the Adsorption of Humic Acids

A Unified Hamiltonian Formalism of Jahn-Teller and Pseudo-Jahn-Teller Problems in Axial Symmetries

Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modelling

NaI Revisited: Theoretical Investigation of Predissociation via Ultrafast XUV Transient Absorption Spectroscopy

Combustion Driven by Fragment-based Ab Initio Molecular Dynamics Simulation

How to Manipulate Through-Space Conjugation and Clusterolumi-nescence of Simple AIEgens with Isolated Phenyl Rings?

119 results in Authors: An Zeng