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Physical Chemistry Chemical Physics : PCCP|December 7, 2017
Structures and infrared spectra of calcium phosphate clusters by ab initio methods with implicit solvation modelsTzu-Jen Lin, Cheng-Chau ChiuPhysical Chemistry Chemical Physics : PCCP|December 12, 2019
Influence of nonmetal dopants on charge separation of graphitic carbon nitride by time-dependent density functional theoryTzu-Jen Lin, Cheng-Chau ChiuChemical Science|November 17, 2017
Molecular understandings on the activation of light hydrocarbons over heterogeneous catalystsZhi-Jian Zhao, Cheng-Chau Chiu, Jinlong GongPhysical Chemistry Chemical Physics : PCCP|April 22, 2025
Collision-induced dissociation mass spectra of Na+-tagged aldohexoses simulated from first-principles calculationsHai Thi Huynh, Jer-Lai Kuo, Cheng-Chau ChiuPhysical Chemistry Chemical Physics : PCCP|May 22, 2015
C-O cleavage of aromatic oxygenates over ruthenium catalysts. A computational study of reactions at step sitesCheng-chau Chiu, Alexander Genest, Armando Borgna, et al.Chemical Record (New York, N.Y.)|August 16, 2016
Transformations of Organic Molecules over Metal Surfaces: Insights from Computational CatalysisLyudmila Moskaleva, Cheng-Chau Chiu, Alexander Genest, et al.Physical Chemistry Chemical Physics : PCCP|March 18, 2020
Improved agreement between experimental and computational results for collision-induced dissociation mass spectrometry of cation-tagged hexosesCheng-Chau Chiu, Chih-Kai Lin, Jer-Lai KuoPhysical Chemistry Chemical Physics : PCCP|February 6, 2020
From the perspectives of DFT calculations, thermodynamic modeling, and kinetic Monte Carlo simulations: the interaction between hydrogen and Sc2C monolayersThong Nguyen-Minh Le, Cheng-Chau Chiu, Jer-Lai KuoPhysical Chemistry Chemical Physics : PCCP|October 5, 2021
A decomposition mechanism for Mn2(DSBDC) metal-organic frameworks in the presence of water moleculesThong Nguyen-Minh Le, Cheng-Chau Chiu, Jer-Lai KuoACS Applied Materials & Interfaces|September 8, 2016
Tunable Gravimetric and Volumetric Hydrogen Storage Capacities in Polyhedral Oligomeric Silsesquioxane FrameworksAmol Deshmukh, Cheng-Chau Chiu, Yun-Wen Chen, et al.Pageof 3