Full List of Preprints co-authored by Simon Rihm.

345: Leveraging General Molecular Fragments to Expand the Design Space of Metal-Organic Polyhedra

Patrick Butler, Simon D. Rihm, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 345, c4e-Preprint Series, Cambridge, 2026.

343: Ontology-to-tools compilation for executable semantic control of large language models

Xiaochi Zhou, Patrick Butler, Changxuan Yang, Simon D. Rihm, Thitikarn Angkanaporn, Jethro Akroyd, Sebastian Mosbach, and Markus Kraft, Technical Report 343, c4e-Preprint Series, Cambridge, 2026.

341: Computational Modelling Workflows for Metal-Organic Polyhedra in The World Avatar

Patrick Butler, Arravind Subramanian, Simon D. Rihm, Ari F. Fischer, Tej S. Choksi, Aleksandar Kondinski, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 341, c4e-Preprint Series, Cambridge, 2025.

340: Inverse Design of Metal-Organic Polyhedra through Molecular Fragmentation and Evolutionary Optimisation

Patrick Butler, Simon D. Rihm, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 340, c4e-Preprint Series, Cambridge, 2025.

339: Product design, synthesis and lab automation with The World Avatar

Simon D. Rihm, Aleksandar Kondinski, and Markus Kraft, Technical Report 339, c4e-Preprint Series, Cambridge, 2025.

336: Extraction of chemical synthesis information using The World Avatar

Simon D. Rihm, Fabio Saluz, Aleksandar Kondinski, Jiaru Bai, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 336, c4e-Preprint Series, Cambridge, 2025.

335: twa: The World Avatar Python package for dynamic knowledge graphs and its application in reticular chemistry

Jiaru Bai, Simon D. Rihm, Aleksandar Kondinski, Fabio Saluz, Xinhong Deng, George Brownbridge, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 335, c4e-Preprint Series, Cambridge, 2025.

329: Automated Assembly Modelling of Metal-Organic Polyhedra

Aleksandar Kondinski, Andrea M Oyarzún, Simon D. Rihm, Jiaru Bai, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 329, c4e-Preprint Series, Cambridge, 2024.

327: Natural Language Access Point to Digital Metal-Organic Polyhedra Chemistry in The World Avatar

Dan N. Tran, Simon D. Rihm, Aleksandar Kondinski, Laura Pascazio, Fabio Saluz, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 327, c4e-Preprint Series, Cambridge, 2024.

322: Hacking Decarbonisation with a Community-Operated CreatorSpace

Aleksandar Kondinski, Sebastian Mosbach, Jethro Akroyd, Andrew Breeson, Yong Ren Tan, Simon D. Rihm, Jiaru Bai, and Markus Kraft, Technical Report 322, c4e-Preprint Series, Cambridge, 2023.

318: The Digital Lab Manager: Automating Research Support

Simon D. Rihm, Yong Ren Tan, Wilson Ang, Markus Hofmeister, Xinhong Deng, Michael Teguh Laksana, Hou Yee Quek, Jiaru Bai, Laura Pascazio, Sim Chun Siong, Jethro Akroyd, Sebastian Mosbach, and Markus Kraft, Technical Report 318, c4e-Preprint Series, Cambridge, 2024.

316: The Digital Lab Facility Manager: Using dynamic knowledge graph technology to automate operations of research laboratories

Simon D. Rihm, Yong Ren Tan, Wilson Ang, Hou Yee Quek, Xinhong Deng, Michael Teguh Laksana, Jethro Akroyd, Sebastian Mosbach, and Markus Kraft, Technical Report 316, c4e-Preprint Series, Cambridge, 2023.

315: Question-answering system for combustion kinetics

Laura Pascazio, Dan N. Tran, Simon D. Rihm, Jiaru Bai, Jethro Akroyd, Sebastian Mosbach, and Markus Kraft, Technical Report 315, c4e-Preprint Series, Cambridge, 2023.

314: The Digital Lab Framework as part of The World Avatar

Simon D. Rihm, Jiaru Bai, Aleksandar Kondinski, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 314, c4e-Preprint Series, Cambridge, 2023.

311: BIM-GIS Integration: Knowledge graphs in a world of data silos

Hou Yee Quek, Markus Hofmeister, Simon D. Rihm, Jingya Yan, Jiawei Lai, George Brownbridge, Michael Hillman, Sebastian Mosbach, Wilson Ang, Yi-Kai Tsai, Dan N. Tran, Soon Kang, William Tan, and Markus Kraft, Technical Report 311, c4e-Preprint Series, Cambridge, 2023.

310: From Platform to Knowledge Graph: Distributed Self-Driving Laboratories

Jiaru Bai, Sebastian Mosbach, Connor J. Taylor, Dogancan Karan, Kok Foong Lee, Simon D. Rihm, Jethro Akroyd, Alexei A. Lapkin, and Markus Kraft, Technical Report 310, c4e-Preprint Series, Cambridge, 2023.

306: A chemical species ontology for data integration and knowledge discovery

Laura Pascazio, Simon D. Rihm, Ali Naseri, Sebastian Mosbach, Jethro Akroyd, and Markus Kraft, Technical Report 306, c4e-Preprint Series, Cambridge, 2023.

299: On the role of C₄ and C₅ products in electrochemical CO₂ reduction

Simon D. Rihm, Mikhail K. Kovalev, Alexei A. Lapkin, Joel W. Ager, and Markus Kraft, Technical Report 299, c4e-Preprint Series, Cambridge, 2022.

289: Modelling a detailed kinetic mechanism for electrocatalytic reduction of CO₂

Simon D. Rihm, Jethro Akroyd, and Markus Kraft, Technical Report 289, c4e-Preprint Series, Cambridge, 2022.