Gregory A. Chass - Publications, H-index & Citations

Gregory A. Chass

Queen Mary University of London

28H指数

143论文数

4.2K被引数

收录论文 28

发表时间

Benchmarking on-the-Fly Machine Learning Force Fields for Ion Hydration: Structure, Coordination, and Exchange Dynamics across Monovalent and Divalent Cations 针对离子水合的实时机器学习力场基准测试：单价和二价阳离子结构、配位及交换动力学

Journal of Physical Chemistry B

IF2.9

2026-09-17

PREAI

Mohammed S. Salha; Wuyang Lin; Gregory Chass; Devis Di Tommaso

Al-driven magnesium alloy functionality via manifold structuring and disorder 通过多重结构化和无序化实现铝驱动的镁合金功能化

Journal of Magnesium and Alloys

IF13.8

2026-08-08

OAAI

Alina Zakrjevsky; Mohammed S. Salha; Henry Adenusi; Rickey Y. Yada; Gin-Gee Khat; David F. Farrar; Devis Di Tommaso; Kun Viviana Tian; Gregory A. Chass

Al-driven cement functionality by manifold structuring & disorder 多流形结构与无序驱动的AI水泥功能化

Mater. Adv.

IF0

2025-10-16

OAAI

Mohammed S. Salha; Henry Adenusi; David H. Setiadi; Rickey Y. Yada; David H. Farrar; Devis Di Tommaso; Kun V. Tian; Gregory A. Chass

Nickel-Catalyzed Three-Component Unsymmetrical Bis-Allylation of Alkynes with Alkenes: A Density Functional Theory Study

MOLECULES

IF4.6

2024-03-26

OAAI

Yu, Tao; Zhang, Jingxuan; Liu, Guo; Duan, Liangfei; Tian, Kun V.; Chass, Gregory A.; Mu, Weihua

Lithium Batteries and the Solid Electrolyte Interphase (SEI)-Progress and Outlook 锂电池与固体电解质界面 (SEI) 的研究进展与展望

ADVANCED ENERGY MATERIALS

IF26

2023-01-18

219

OAAI

Adenusi, Henry; Chass, Gregory A.; Passerini, Stefano; Tian, Kun V.; Chen, Guanhua

Pd-NHC catalysed regioselective activation of B(3,6)-H of o-carborane - a synergy between experiment and theory

DALTON TRANSACTIONS

IF3.3

2023-01-01

PREAI

Yu, Jia-Wei; Zhang, Cai-Yan; Chass, Gregory A.; Zhang, Jing-Xuan; Mu, Wei-Hua; Cao, Ke

Optimal Icosahedral Copper-Based Bimetallic Clusters for the Selective Electrocatalytic CO2 Conversion to One Carbon Products

NANOMATERIALS

IF4.3

2022-12-24

OAAI

Nabi, Azeem Ghulam; Aman-ur-Rehman, Akhtar; Hussain, Akhtar A.; Chass, Gregory A.; Di Tommaso, Devis

A Database of Solution Additives Promoting Mg2+ Dehydration and the Onset of MgCO3 Nucleation

CRYSTAL GROWTH & DESIGN

IF3.4

2022-04-05

OAAI

Toroz, Dimitrios; Song, Fu; Uddin, Amira; Chass, Gregory A.; Di Tommaso, Devis

From Molten Calcium Aluminates through Phase Transitions to Cement Phases

ADVANCED SCIENCE

IF14.1

2019-11-26

OAAI

Liu, Hao; Chen, Wenlin; Pan, Ruikun; Shan, Zhitao; Qiao, Ang; Drewitt, James W. E.; Hennet, Louis; Jahn, Sandro; Langstaff, David P.; Chass, Gregory A.; Tao, Haizheng; Yue, Yuanzheng; Greaves, G. Neville

Composition?Nanostructure Steered Performance Predictions in Steel Wires

NANOMATERIALS

IF4.3

2019-08-03

OAAI

Tian, Kun, V; Passaretti, Francesca; Nespoli, Adelaide; Placidi, Ernesto; Condo, Roberta; Andreani, Carla; Licoccia, Silvia; Chass, Gregory A.; Senesi, Roberto; Cozza, Paola

Reduction Rate of 1-Phenyl Phospholane 1-Oxide Enhanced by Silanol Byproducts: Comprehensive DFT Study and Kinetic Modeling Linked to Reagent Design

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2018-05-29

PREAI

Fianchini, Mauro; O'Brien, Christopher J.; Chass, Gregory A.

The pivotal role of electronics in preferred alkene over alkyne Ni-carboryne insertions and absolute regioselectivities

DALTON TRANSACTIONS

IF3.3

2018-01-01

PREAI

Mu, Wei-Hua; Cheng, Rui-Jiao; Fang, De-Cai; Chass, Gregory A.

Periodic vs. molecular cluster approaches to resolving glass structure and properties: Anorthite a case study

JOURNAL OF NON-CRYSTALLINE SOLIDS

IF3.5

2016-11-01

OAAI

Tian, Kun V.; Mahmoud, Mustafa Z.; Cozza, Paola; Licoccia, Silvia; Fang, De-Cai; Di Tommaso, Devis; Chass, Gregory A.; Greaves, G. Neville

Multi-Pathway Consequent Chemoselectivities of CpRuCl(PPh3)2/MeI-Catalysed Norbornadiene Alkyne Cycloadditions CpRuCl(PPh3)2/MeI催化的降冰片二烯炔烃环加成反应的多途径化学选择性

CHEMISTRY-A EUROPEAN JOURNAL

IF3.7

2016-09-13

OAAI

Mu, Wei-Hua; Fang, De-Cai; Xia, Shu-Ya; Cheng, Rui-Jiao; Chass, Gregory A.

Excitonic Character in Optical Properties of Tetrahedral CdX (X = S, Se, Te) Clusters

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2015-12-21

PREAI

Zhu, Xi; Chass, Gregory A.; Kwek, Leong-Chuan; Rogach, Andrey L.; Su, Haibin

Atomic and vibrational origins of mechanical toughness in bioactive cement during setting

NATURE COMMUNICATIONS

IF15.7

2015-11-09

OAAI

Tian, Kun V.; Yang, Bin; Yue, Yuanzheng; Bowron, Daniel T.; Mayers, Jerry; Donnan, Robert S.; Dobo-Nagy, Csaba; Nicholson, John W.; Fang, De-Cai; Greer, A. Lindsay; Chass, Gregory A.; Greaves, G. Neville

Competing Mechanisms, Substituent Effects, and Regioselectivities of Nickel-Catalyzed [2+2+2] Cycloaddition between Carboryne and Alkynes: A DFT Study

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2015-09-01

PREAI

Mu, Wei-Hua; Xia, Shu-Ya; Li, Ji-Xiang; Fang, De-Cai; Wei, Gang; Chass, Gregory A.

Phase separation in an ionomer glass: Insight from calorimetry and phase transitions

JOURNAL OF NON-CRYSTALLINE SOLIDS

IF3.5

2015-05-01

PREAI

Pedersen, Malene T.; Tian, Kun V.; Dobo-Nagy, Csaba; Chass, Gregory A.; Greaves, G. Neville; Yue, Yuanzheng

How the Surface Structure Determines the Properties of CuH

INORGANIC CHEMISTRY

IF4.7

2015-02-11

OAAI

Bennett, Elliot; Wilson, Thomas; Murphy, Patrick J.; Refson, Keith; Hannon, Alex C.; Imberti, Silvia; Callear, Samantha K.; Chass, Gregory A.; Parker, Stewart F.

Pd(OAc)2-Catalyzed C-H Activation/C-O Cyclization: Mechanism, Role of Oxidant-Probed by Density Functional Theory

JOURNAL OF ORGANIC CHEMISTRY

IF3.6

2013-08-09

PREAI

Lian, Bing; Zhang, Lei; Chass, Gregory Adam; Fang, De-Cai

研究方向