| Reactivity of polycyclic aromatic hydrocarbon soot precursors: implications of localized π-radicals on rim-based pentagonal rings JW Martin, D Hou, A Menon, L Pascazio, J Akroyd, X You, M Kraft The Journal of Physical Chemistry C 123 (43), 26673-26682, 2019 | 61 | 2019 |
| Optical band gap of cross-linked, curved, and radical polyaromatic hydrocarbons A Menon, JAH Dreyer, JW Martin, J Akroyd, J Robertson, M Kraft Physical Chemistry Chemical Physics 21 (29), 16240-16251, 2019 | 61 | 2019 |
| Polar curved polycyclic aromatic hydrocarbons in soot formation JW Martin, K Bowal, A Menon, RI Slavchov, J Akroyd, S Mosbach, M Kraft Proceedings of the Combustion Institute 37 (1), 1117-1123, 2019 | 56 | 2019 |
| π-Diradical aromatic soot precursors in flames JW Martin, L Pascazio, A Menon, J Akroyd, K Kaiser, F Schulz, ... Journal of the American Chemical Society 143 (31), 12212-12219, 2021 | 51 | 2021 |
| An ontology and semantic web service for quantum chemistry calculations N Krdzavac, S Mosbach, D Nurkowski, P Buerger, J Akroyd, J Martin, ... Journal of chemical information and modeling 59 (7), 3154-3165, 2019 | 48 | 2019 |
| From database to knowledge graphusing data in chemistry A Menon, NB Krdzavac, M Kraft Current Opinion in Chemical Engineering 26, 33-37, 2019 | 39 | 2019 |
| Reactivity of polycyclic aromatic hydrocarbon soot precursors: Kinetics and equilibria A Menon, JW Martin, J Akroyd, M Kraft The Journal of Physical Chemistry A 124 (48), 10040-10052, 2020 | 30 | 2020 |
| Multiscale cross-domain thermochemical knowledge-graph S Mosbach, A Menon, F Farazi, N Krdzavac, X Zhou, J Akroyd, M Kraft Journal of Chemical Information and Modeling 60 (12), 6155-6166, 2020 | 29 | 2020 |
| Linking reaction mechanisms and quantum chemistry: An ontological approach F Farazi, NB Krdzavac, J Akroyd, S Mosbach, A Menon, D Nurkowski, ... Computers & Chemical Engineering 137, 106813, 2020 | 28 | 2020 |
| Reactive localized π-radicals on rim-based pentagonal rings: properties and concentration in flames A Menon, JW Martin, G Leon, D Hou, L Pascazio, X You, M Kraft Proceedings of the Combustion Institute 38 (1), 565-573, 2021 | 22 | 2021 |
| Predicting power conversion efficiency of organic photovoltaics: models and data analysis A Eibeck, D Nurkowski, A Menon, J Bai, J Wu, L Zhou, S Mosbach, ... ACS omega 6 (37), 23764-23775, 2021 | 21 | 2021 |
| Aromatic penta-linked hydrocarbons in soot nanoparticle formation L Pascazio, JW Martin, A Menon, D Hou, X You, M Kraft Proceedings of the Combustion Institute 38 (1), 1525-1532, 2021 | 21 | 2021 |
| A density functional theory study on the kinetics of seven-member ring formation in polyaromatic hydrocarbons A Menon, G Leon, J Akroyd, M Kraft Combustion and Flame 217, 152-174, 2020 | 21 | 2020 |
| Kinetic Monte Carlo statistics of curvature integration by HACA growth and bay closure reactions for PAH growth in a counterflow diffusion flame G Leon, A Menon, L Pascazio, EJ Bringley, J Akroyd, M Kraft Proceedings of the Combustion Institute 38 (1), 1449-1457, 2021 | 14 | 2021 |
| Dynamic polarity of curved aromatic soot precursors JW Martin, A Menon, CT Lao, J Akroyd, M Kraft Combustion and Flame 206, 150-157, 2019 | 14 | 2019 |
| The combustion of solid paraffin wax and of liquid glycerol in a fluidised bed A Menon, N Waller, W Hu, AN Hayhurst, JF Davidson, SA Scott Fuel 199, 447-455, 2017 | 13 | 2017 |
| Question answering system for chemistryA semantic agent extension X Zhou, D Nurkowski, A Menon, J Akroyd, S Mosbach, M Kraft Digital Chemical Engineering 3, 100032, 2022 | 12 | 2022 |
| OntoPESScan: An ontology for potential energy surface scans A Menon, L Pascazio, D Nurkowski, F Farazi, S Mosbach, J Akroyd, ... ACS omega 8 (2), 2462-2475, 2023 | 7 | 2023 |
| FLiPPID flame pyrometry python code J Dreyer, RI Slavchov, A Menon | 5 | 2019 |
| When Do Quantum Mechanical Descriptors Help Graph Neural Networks to Predict Chemical Properties? SC Li, H Wu, A Menon, KA Spiekermann, YP Li, WH Green Journal of the American Chemical Society 146 (33), 23103-23120, 2024 | 4 | 2024 |
Markus KraftUniversity of Cambridge, Nanyang Technological UniversityPatvirtintas el. paštas cam.ac.uk
