2023

Cooper Group publications from 2023.

Modular, multi-robot integration of laboratories: an autonomous workflow for solid-state chemistry

Amy M Lunt, Hatem Fakhruldeen, Gabriella Pizzuto, Louis Longley, Alexander White, Nicola Rankin, Rob Clowes, Ben Alston, Lucia Gigli, Graeme M Day, Andrew I Cooper, Samantha Y Chong

Chem. Sci., 2024, 15, 2456

Machine learning accelerated exploration of ternary organic heterojunction photocatalysts for sacrificial hydrogen evolution

H Yang, Y Che, AI Cooper, L Chen, X Li

J. Am. Chem. Soc., 2023, 145 (49), 27038

Domain knowledge injection in Bayesian search for new materials

Z Xie, X Evangelopoulos, J Thacker, A Cooper

arXiv preprint arXiv:2311.15162

Go with the flow: deep learning methods for autonomous viscosity estimations

M Walker, G Pizzuto, H Fakhruldeen, AI Cooper

Digital Discovery,2023, 2 (5), 1540

Soft hydrogen-bonded organic frameworks constructed using a flexible organic cage hinge

Qiang Zhu, Lei Wei, Chengxi Zhao, Hang Qu, Bowen Liu, Thomas Fellowes, Siyuan Yang, Alexandra Longcake, Michael J. Hall, Michael R. Probert, Yingbo Zhao, Andrew I. Cooper*, and Marc A. Little*

J. Am. Chem. Soc., 2023

Powder-Bot: A modular autonomous multi-robot workflow for powder X-ray diffraction

Amy M. Lunt, Hatem Fakhruldeen, Gabriella Pizzuto, Louis Longley, Alexander White, Nicola Rankin, Rob Clowes, Ben M. Alston, Andrew I. Cooper, Samantha Y. Chong

arXiv preprint arXiv:2309.00544

Controlling the crystallisation and hydration state of crystalline porous organic salts

Megan O'Shaughnessy, Alex C. Padgham, Rob Clowes, Marc A. Little, Michael C. Brand, Hang Qu, Anna G. Slater, Andrew I. Cooper

Chemistry–A European Journal, 2023, e202302420

Fine-tuning GPT-3 for machine learning electronic and functional properties of organic molecules

Zikai Xie, Xenophon Evangelopoulos, Ömer Omar, Alessandro Troisi, Andrew I. Cooper, Linjiang Chen

ChemRxiv preprint

HypBO: Expert-guided chemist-in-the-loop Bayesian search for new materials

Abdoulatif Cisse, Xenophon Evangelopoulos, Sam Carruthers, Vladimir V. Gusev, Andrew I. Cooper

arXiv preprint arXiv:2308.11787

Leveraging multi-modal sensing for robotic insertion tasks in R&D laboratories

Aaron Butterworth, Gabriella Pizzuto, Leszek Pecyna, Andrew I Cooper, Shan Luo

arXiv preprint arXiv:2307.00671

Fluorinated covalent organic frameworks coupled with molecular cobalt cocatalysts for efficient photocatalytic CO2 reduction

Zhiwei Fu, Chang Shu, Xiaoyan Wang, Linjiang Chen, Xue Wang, Lunjie Liu, Kewei Wang, Rob Clowes, Samantha Y Chong, Xiaofeng Wu, Andrew I Cooper,

CSC Chemistry, 2023

Experimental confirmation of a predicted porous hydrogen‐bonded organic framework

Caitlin E Shields, Xue Wang, Thomas Fellowes, Rob Clowes, Linjiang Chen, Graeme M Day, Anna G Slater, John W Ward, Marc A Little, Andrew I Cooper

Chem.Int., 2023, 62, e202303167

Packing-induced selectivity switching in molecular nanoparticle photocatalysts for hydrogen and hydrogen peroxide production

Haofan Yang, Chao Li, Tao Liu, Thomas Fellowes, Samantha Y Chong, Luca Catalano, Mounib Bahri, Weiwei Zhang, Yongjie Xu, Lunjie Liu, Wei Zhao, Adrian M Gardner, Rob Clowes, Nigel D Browning, Xiaobo Li, Alexander J Cowan, Andrew I Cooper

Nature Nanotechnology, 2023, 18 (3), 307

Investigating the factors that influence sacrificial hydrogen evolution activity for three structurally-related molecular photocatalysts: thermodynamic driving force, excited-state dynamics, and surface interaction with cocatalysts

Tao Liu, Linjiang Chen, Xiaobo Li, Andrew I Coope

Phys. Chem. Chem. Phys., 2023, 25, 3494

Competitive animal formation during the synthesis of a highly soluble, isopropyl-decorated imine porous organic cage

Rachel J Kearsey, Andrew Tarzia, Marc A Little, Michael C Brand, Rob Clowes, Kim E Jelfs, Andrew I Cooper, Rebecca L Greenaway

Chem. Commun., 2023, 59, 3731