By Dr Laura McKemmish

Preprints

McKemmish LK, 2021, Molecular diatomic spectroscopy data, http://dx.doi.org/10.1002/wcms.1520

McKemmish LK; Syme A-M; Borsovszky J; Yurchenko SN; Tennyson J; Furtenbacher T; Csaszar AG, 2020, An update to the MARVEL dataset and ExoMol line list for 12C2, http://dx.doi.org/10.1093/mnras/staa1954

Syme A-M; McKemmish LK, 2020, Computational insight into diatomic molecules as probes to measure the variation of the proton-to-electron mass ratio, http://dx.doi.org/10.3847/2515-5172/abae03

Syme A-M; McKemmish LK, 2020, Experimental energy levels of 12C14N through MARVEL analysis, http://dx.doi.org/10.1093/mnras/staa2791

Zapata JC; McKemmish LK, 2020, On the Computation of Dipole Moments: A Recommendation on the Choice of the Basis Set and the Level of Theory, http://dx.doi.org/10.1021/acs.jpca.0c06736

Pavlenko YV; Yurchenko SN; McKemmish LK; Tennyson J, 2020, Analysis of the TiO isotopologues in stellar optical spectra, http://dx.doi.org/10.1051/0004-6361/202037863

Tennyson J; Yurchenko SN; Al-Refaie AF; Clark VHJ; Chubb KL; Conway EK; Dewan A; Gorman MN; Hill C; Lynas-Gray AE; Mellor T; McKemmish LK; Owens A; Polyansky OL; Semenov M; Somogyi W; Tinetti G; Upadhyay A; Waldmann I; Wang Y; Wright S; Yurchenko OP, 2020, The 2020 release of the ExoMol database: molecular line lists for exoplanet and other hot atmospheres, http://dx.doi.org/10.1016/j.jqsrt.2020.107228

Piette AAA; Madhusudhan N; McKemmish LK; Gandhi S; Masseron T; Welbanks L, 2020, Assessing Spectra and Thermal Inversions due to TiO in Hot Jupiter Atmospheres, http://dx.doi.org/10.48550/arxiv.2006.04807

Cox CS; Zapata JC; McKemmish LK, 2020, Mixed ramp-Gaussian basis sets for core-dependent properties: STO-RG and STO-R2G for Li-Ne, http://dx.doi.org/10.1071/CH19466

Merritt SR; Gibson NP; Nugroho SK; de Mooij EJW; Hooton MJ; Matthews SM; McKemmish LK; Mikal-Evans T; Nikolov N; Sing DK; Spake JJ; Watson CA, 2020, Non-detection of TiO and VO in the atmosphere of WASP-121b using high-resolution spectroscopy, http://dx.doi.org/10.48550/arxiv.2002.02795

Syme A-M; Mousley A; Cunningham M; McKemmish LK, 2020, Diatomic rovibronic transitions as potential probes for proton-to-electron mass ratio across cosmological time, http://dx.doi.org/10.1071/CH19448

Rivlin T; McKemmish LK; Spinlove KE; Tennyson J, 2019, Low-temperature scattering with the R-matrix method: from nuclear scattering to atom-atom scattering and beyond, http://dx.doi.org/10.48550/arxiv.1911.00027

McKemmish LK; Masseron T; Hoeijmakers HJ; Perez-Mesa V; Grimm SL; Yurchenko SN; Tennyson J, 2019, ExoMol Molecular linelists -- XXXIII. The spectrum of Titanium Oxide, http://dx.doi.org/10.1093/mnras/stz1818

Rivlin T; McKemmish LK; Spinlove KE; Tennyson J, 2019, Low temperature scattering with the R-matrix method: argon-argon scattering, http://dx.doi.org/10.1080/00268976.2019.1615143

McKemmish LK; Tennyson J, 2019, General Mathematical Formulation of Scattering Processes in Atom-Diatomic Collisions in the RmatReact Methodology, http://arxiv.org/abs/1902.02545v1

Mizus II; Polyansky OL; McKemmish LK; Tennyson J; Alijah A; Zobov NF, 2018, A global potential energy surface for H$_3^+$, http://dx.doi.org/10.1080/00268976.2018.1554195

McKemmish LK; Borsovszky J; Goodhew KL; Sheppard S; Bennett AFV; Martin ADJ; Singh A; Sturgeon CAJ; Furtenbacher T; Csaszar AG; Tennyson J, 2018, MARVEL Analysis of the Measured High-Resolution Rovibronic Spectra of 90Zr16O, http://dx.doi.org/10.3847/1538-4357/aadd19

Rivlin T; McKemmish LK; Tennyson J, 2018, Low temperature scattering with the R-matrix method: the Morse potential, http://arxiv.org/abs/1810.03475v1

Yurchenko SN; Bond W; Gorman MN; Lodi L; McKemmish LK; Nunn W; Shah R; Tennyson J, 2018, ExoMol molecular line lists - XXVI: spectra of SH and NS, http://dx.doi.org/10.48550/arxiv.1803.09724

Tsiaras A; Waldmann IP; Zingales T; Rocchetto M; Morello G; Damiano M; Karpouzas K; Tinetti G; McKemmish LK; Tennyson J; Yurchenko SN, 2017, A population study of gaseous exoplanets, http://dx.doi.org/10.48550/arxiv.1704.05413

McKemmish LK; Masseron T; Sheppard S; Sandeman E; Schofield Z; Furtenbacher T; Csaszar AG; Tennyson J; Sousa-Silva C, 2017, MARVEL analysis of the measured high-resolution rovibronic spectra of $^{48}$Ti$^{16}$O, http://dx.doi.org/10.3847/1538-4365/228/2/15

McKemmish LK; Yurchenko SN; Tennyson J, 2016, ExoMol line lists XVIII. The high temperature spectrum of VO, http://dx.doi.org/10.1093/mnras/stw1969

Tennyson J; McKemmish LK; Rivlin T, 2016, Low-temperature chemistry using the R-matrix method, http://dx.doi.org/10.1039/C6FD00110F

McKemmish LK; Yurchenko SN; Tennyson J, 2016, Ab initio calculations to support accurate modelling of the rovibronic spectroscopy calculations of vanadium monoxide (VO), http://dx.doi.org/10.1080/00268976.2016.1225994

Tennyson J; Lodi L; McKemmish LK; Yurchenko SN, 2016, The {\it ab initio} calculation of spectra of open shell diatomic molecules, http://dx.doi.org/10.1088/0953-4075/49/10/102001

Tennyson J; Yurchenko SN; Al-Refaie AF; Barton EJ; Chubb KL; Coles PA; Diamantopoulou S; Gorman MN; Hill C; Lam AZ; Lodi L; McKemmish LK; Na Y; Owens A; Polyansky OL; Sousa-Silva C; Underwood DS; Yachmenev A; Zak E, 2016, The ExoMol database: molecular line lists for exoplanet and other hot atmospheres, http://dx.doi.org/10.1016/j.jms.2016.05.002

McKemmish LK; McKenzie RH; Hush NS; Reimers JR, 2011, Quantum entanglement between electronic and vibrational degrees of freedom in molecules, http://dx.doi.org/10.48550/arxiv.1107.1105

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