By Associate Professor Terry James Frankcombe

Journal articles

Frankcombe TJ; Smith SC, 2003, 'Fast, scalable master equation solution algorithms. IV. Lanczos iteration with diffusion approximation preconditioned iterative inversion', The Journal of chemical physics, 119, pp. 12741 - 12748

Frankcombe TJ; Smith SC, 2003, 'Selecting methods to solve multi-well master equations', Journal of Theoretical and Computational Chemistry, 2, pp. 179 - 191

Frankcombe T; Smith S, 2002, 'Progress toward calculation of carbon gasification thermal rate constants.', ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 224, pp. U557 - U557, https://www.webofscience.com/api/gateway?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000177422202834&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=891bb5ab6ba270e68a29b250adbe88d1

Frankcombe TJ; Bhatia SK; Smith SC, 2002, 'Ab initio modelling of basal plane oxidation of graphenes and implications for modelling char combustion', Carbon, 40, pp. 2341 - 2349

Frankcombe TJ; Smith SC, 2002, 'Time-dependent master equation simulation of complex elementary reactions in combustion: Application to the reaction of 1 CH 2 with C 2 H 2 from 300–2000 K', Faraday discussions, 119, pp. 159 - 171

Frankcombe TJ; Smith SC, 2001, 'Time evolution in the unimolecular master equation at low temperatures: full spectral solution with scalable iterative methods and high precision', Computer physics communications, 141, pp. 39 - 54

Frankcombe TJ; Smith SC; Gates KE; Robertson SH, 2000, 'A master equation model for bimolecular reaction via multi-well isomerizing intermediates', Physical Chemistry Chemical Physics, 2, pp. 793 - 803

Frankcombe TJ; Smith SC, 2000, 'Solving the unimolecular master equation with a weighted subspace projection method', Journal of Computational Chemistry, 21, pp. 592 - 606

Frankcombe TJ; Stranger R; Schranz HW, 1998, 'The intermolecular potential energy surface of CO₂-Ar and its effect on collisional energy transfer', INTERNET JOURNAL OF CHEMISTRY, 1, pp. CP1 - U25

Conference Papers

Li A; Abpeikar S; Wang M; Frankcombe T; Ghodrat M, 2024, 'An Exploratory Review on Lithium-Ion Battery Fire Risk Mitigation Using Deep Learning Approaches', in Kramer M; Niven R; Ghodrat M; Liow J-L (eds.), Proceedings of the 24th Australasian Fluid Mechanics Conference, Australasian Fluid Mechanics Society (AFMS), Canberra, presented at The 24th Australasian Fluid Mechanics Conference (AFMC2024), Canberra, 01 December 2024 - 05 December 2024, http://dx.doi.org/10.5281/zenodo.14213411

Díaz C; Muzas AS; Del Cueto M; Frankcombe TJ; Martín F; Hund ZM; Nihill KJ; Sibener SJ, 2015, 'Understanding the rotational excitation in scattering of D2 from CH3-Si(111)', in Journal of Physics Conference Series, http://dx.doi.org/10.1088/1742-6596/635/3/032007

Johnson AWS; Nakashima PNH; Frankcombe TJ, 2011, 'Bonding charge density in srtio(3) under an electric field measured by electron diffraction', in ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, INT UNION CRYSTALLOGRAPHY, pp. C175 - C175, http://dx.doi.org/10.1107/S0108767311095651

Conference Posters

Ghose K; Frankcombe T, 2022, 'Comparative First-Principles Phonon Dispersion of Rutile and Anatase TiO2', Brisbane, Australia, presented at RACI 2022 National Congress, Brisbane, Australia, 03 July 2022 - 08 July 2022

Preprints

Liu Y; Frankcombe T; Schmidt T, 2025, Energetics of Covalent Bonding from Wave Function Tiles, http://dx.doi.org/10.26434/chemrxiv-2025-l49g4

Tang C; Permude P; Fei S; Frankcombe TJ; Smith SC; Liu Y, 2023, Critical dehydrogenation steps of perhydro-N-ethylcarbazole on Ru(0001) surface, http://dx.doi.org/10.48550/arxiv.2310.15451

Nekouei F; Wen X; Zheng Z; Sun Q; Lu T; Orton H; Kremer F; Nekouei S; Yuan T; Abdelkader EH; Liu B; Tricoli A; Otting G; Liu Z; Frankcombe T; Liu Y, Inooh-Mediated Intergrown Heterojunctions for Enhanced Photocatalytic Performance: Assembly and Interfacial Charge Carrier Transferring, http://dx.doi.org/10.2139/ssrn.4028180

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