Cheng-chau Chiu

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Alexander GenestInstitute of Materials Chemistry, TU ViennaVerified email at tuwien.ac.at
Jer-Lai KuoIAMS, Academia SinicaVerified email at pub.iams.sinica.edu.tw
Jinlong GongCheung Kong Chair Professor, Tianjin UniversityVerified email at tju.edu.cn
Zhao Zhi-Jian(赵志坚)Professor, Tianjin UniversityVerified email at tju.edu.cn
TZU-JEN LINChung Yuan Christian UniversityVerified email at cycu.edu.tw
Po-Jen HsuInstitute of Atomic and Molecular Sciences, Academia SinicaVerified email at pchome.com.tw
Chi-Kung NiInstitute of Atomic and Molecular Sciences, Academia SinicaVerified email at po.iams.sinica.edu.tw
Le Nguyen Minh ThongCenter for Innovative Materials and Architectures (INOMAR)Verified email at inomar.edu.vn
Georgi N. VayssilovUniversity of SofiaVerified email at chem.uni-sofia.bg
Thomas VogtUniversity of South CarolinaVerified email at mailbox.sc.edu
Jake TanPostdoctoral Fellow, Virginia Commonwealth UniversityVerified email at vcu.edu
JW LiLudwig Maximilian University of MunichVerified email at physik.uni-muenchen.de
Hsin-Yi LiaoNational Taipei University of EducationVerified email at mail.ntue.edu.tw
Chia-Ying ChiangProfessor of Chemical Engineering, National Taiwan University of Science and TechnologyVerified email at mail.ntust.edu.tw
Truong-Giang VoNational Yang Ming Chiao Tung UniversityVerified email at nycu.edu.tw
Lyudmila MoskalevaUniversität BremenVerified email at uni-bremen.de
Yun-Wen ChenInstitute of Atomic and Molecular SciencesVerified email at pub.iams.sinica.edu.tw
Hayden ThompsonResearch AssistantVerified email at gate.sinica.edu.tw
Zdenek SoferUniversity of Chemistry and Technology PragueVerified email at vscht.cz
Balaraman VedhanarayananJSPS Fellow, Chiba University, JapanVerified email at chiba-u.jp

Cheng-chau Chiu

Department of Chemistry, National Sun Yat-sen University

Verified email at mail.nsysu.edu.tw - Homepage

computational chemistry catalysis gas sorption thermodynamic modeling DFT


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Molecular understandings on the activation of light hydrocarbons over heterogeneous catalysts ZJ Zhao, C Chiu, J Gong Chemical Science 6 (8), 4403-4425, 2015	145	2015
Hydrodeoxygenation of Guaiacol over Ru (0001): A DFT Study C Chiu, A Genest, A Borgna, N Rösch ACS Catalysis 4 (11), 4178-4188, 2014	97	2014
Decomposition of Ethanol Over Ru (0001): A DFT Study. C Chiu, A Genest, N Rösch Topics in Catalysis 56 (11), 2013	34	2013
C–O cleavage of aromatic oxygenates over ruthenium catalysts. A computational study of reactions at step sites C Chiu, A Genest, A Borgna, N Rösch Physical Chemistry Chemical Physics 17 (23), 15324-15330, 2015	28	2015
Predicting adsorption enthalpies on silicalite and HZSM‐5: A benchmark study on DFT strategies addressing dispersion interactions C Chiu, GN Vayssilov, A Genest, A Borgna, N Rösch Journal of computational chemistry 35 (10), 809-819, 2014	28	2014
Tuning the vibrational coupling of H 3 O+ by changing its solvation environment JA Tan, JW Li, C Chiu, HY Liao, HT Huynh, JL Kuo Physical Chemistry Chemical Physics 18 (44), 30721-30732, 2016	20	2016
Structure and electronic properties of MoVO type mixed-metal oxides–a combined view by experiment and theory C Chiu, T Vogt, L Zhao, A Genest, N Rösch Dalton Transactions 44 (31), 13778-13795, 2015	20	2015
Structures and infrared spectra of calcium phosphate clusters by ab initio methods with implicit solvation models TJ Lin, CC Chiu Physical Chemistry Chemical Physics 20 (1), 345-356, 2018	18	2018
Unveiling the crystallographic facet dependence of the photoelectrochemical glycerol oxidation on bismuth vanadate TG Vo, CC Kao, JL Kuo, C Chiu, CY Chiang Applied Catalysis B: Environmental 278, 119303, 2020	14	2020
Evaluation of density functionals for elementary steps of selective oxidation reactions S Dinda, C Chiu, A Genest, N Rösch Computational and Theoretical Chemistry 1101, 36-45, 2017	13	2017
Formation of Propane in the Aqueous‐Phase Processing of 1‐Propanol over Platinum: A DFT Study C Chiu, A Genest, N Rösch ChemCatChem 5 (11), 3299-3308, 2013	13	2013
Influence of nonmetal dopants on charge separation of graphitic carbon nitride by time-dependent density functional theory TJ Lin, C Chiu Physical Chemistry Chemical Physics 22 (2), 647-657, 2020	12	2020
Transformations of Organic Molecules over Metal Surfaces: Insights from Computational Catalysis L Moskaleva, C Chiu, A Genest, N Rösch The Chemical Record 16 (5), 2388-2404, 2016	12	2016
Tunable Gravimetric and Volumetric Hydrogen Storage Capacities in Polyhedral Oligomeric Silsesquioxane Frameworks A Deshmukh, C Chiu, YW Chen, JL Kuo ACS Applied Materials & Interfaces 8 (38), 25219-25228, 2016	12	2016
Unexpected Dissociation Mechanism of Sodiated N-Acetylglucosamine and N-Acetylgalactosamine C Chiu, ST Tsai, PJ Hsu, HT Huynh, JL Chen, HT Phan, SP Huang, ... The Journal of Physical Chemistry A 123 (16), 3441-3453, 2019	11	2019
Toward Closing the Gap between Hexoses and N-Acetlyhexosamines: Experimental and Computational Studies on the Collision-Induced Dissociation of … C Chiu, HT Huynh, ST Tsai, HY Lin, PJ Hsu, HT Phan, A Karumanthra, ... The Journal of Physical Chemistry A 123 (31), 6683-6700, 2019	8	2019
DFT Study on the H₂ Storage Properties of Sc-Decorated Covalent Organic Frameworks Based on Adamantane Units A Deshmukh, TNM Le, C Chiu, JL Kuo The Journal of Physical Chemistry C 122 (29), 16853-16865, 2018	5	2018
DFT cluster model study of Mo V O-type mixed-metal oxides L Zhao, C Chiu, A Genest, N Rösch Computational and Theoretical Chemistry 1045, 57-65, 2014	4	2014
From the perspectives of DFT calculations, thermodynamic modeling, and kinetic Monte Carlo simulations: the interaction between hydrogen and Sc 2 C monolayers TNM Le, C Chiu, JL Kuo Physical Chemistry Chemical Physics 22 (8), 4387-4401, 2020	3	2020
Highly exfoliated NiPS3 nanosheets as efficient electrocatalyst for high yield ammonia production B Vedhanarayanan, C Chiu, J Regner, Z Sofer, KCS Lakshmi, JY Lin, ... Chemical Engineering Journal 430, 132649, 2022	2	2022

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