The intermolecular potential energy surface for CO2–Ar: Fitting to high‐resolution spectroscopy of Van der Waals complexes and second virial coefficients JM Hutson, A Ernesti, MM Law, CF Roche, RJ Wheatley The Journal of chemical physics 105 (20), 9130-9140, 1996 | 100 | 1996 |
Microwave spectroscopy and interaction potential of the long‐range He...Ar+ ion A Carrington, CA Leach, AJ Marr, AM Shaw, MR Viant, JM Hutson, ... The Journal of chemical physics 102 (6), 2379-2403, 1995 | 76 | 1995 |
New vibration–rotation code for tetraatomic molecules exhibiting wide-amplitude motion: WAVR4 IN Kozin, MM Law, J Tennyson, JM Hutson Computer physics communications 163 (2), 117-131, 2004 | 69 | 2004 |
I-NoLLS: A program for interactive nonlinear least-squares fitting of the parameters of physical models MM Law, JM Hutson Computer physics communications 102 (1-3), 252-268, 1997 | 67 | 1997 |
A study of vibrational anharmonicity, fermi resonance interactions, and local mode behavior in CH3Cl JL Duncan, MM Law Journal of Molecular Spectroscopy 140 (1), 13-30, 1990 | 62 | 1990 |
Calculating energy levels of isomerizing tetra-atomic molecules. II. The vibrational states of acetylene and vinylidene IN Kozin, MM Law, J Tennyson, JM Hutson The Journal of chemical physics 122 (6), 064309, 2005 | 54 | 2005 |
Scaled quantum chemical force fields for 1, 1-difluorocyclopropane and the influence of vibrational anharmonicity DC McKean, NC Craig, MM Law The Journal of Physical Chemistry A 112 (29), 6760-6771, 2008 | 42 | 2008 |
Microwave spectroscopy and interaction potential of the long‐range He⋯Kr+ ion: An example of Hund’s case (e) A Carrington, CH Pyne, AM Shaw, SM Taylor, JM Hutson, MM Law The Journal of chemical physics 105 (19), 8602-8614, 1996 | 39 | 1996 |
Joint local- and normal-mode studies of the overtone spectra of the methyl halides: and MM Law The Journal of Chemical Physics 111 (22), 10021-10033, 1999 | 35 | 1999 |
Calculating energy levels of isomerizing tetra-atomic molecules. I. The rovibrational bound states of IN Kozin, MM Law, JM Hutson, J Tennyson The Journal of chemical physics 118 (11), 4896-4904, 2003 | 27 | 2003 |
Anharmonic stretching vibrations expressed as local modes MM Law, JL Duncan Molecular Physics 93 (5), 809-819, 1998 | 27 | 1998 |
Anharmonically-coupled local mode to normal mode Hamiltonian transformations: beyond the x, K-relations MM Law, JL Duncan Molecular Physics 93 (5), 821-830, 1998 | 25 | 1998 |
The general harmonic force field of methyl fluoride MM Law, JL Duncan, IM Mills Journal of Molecular Structure: THEOCHEM 260, 323-331, 1992 | 25 | 1992 |
The general harmonic force field of methyl chloride GM Black, MM Law Journal of molecular spectroscopy 205 (2), 280-285, 2001 | 24 | 2001 |
Local mode and normal mode stretching vibrations in XH4 and XH3 systems: beyond the x, K relations MM Law, JL Duncan Molecular Physics 83 (4), 757-770, 1994 | 21 | 1994 |
Second-order perturbation theory corrections to effective Fermi resonance coupling constants MM Law, JL Duncan Chemical physics letters 212 (1-2), 172-176, 1993 | 21 | 1993 |
The potential energy surface of isomerising disilyne MM Law, JT Fraser-Smith, CU Perotto Physical Chemistry Chemical Physics 14 (19), 6922-6936, 2012 | 20 | 2012 |
Infrared Spectra of CF2CHD and CF2CD2: Scaled Quantum-Chemical Force Fields and an Equilibrium Structure for 1,1-Difluoroethylene DC McKean, MM Law, P Groner, AR Conrad, MJ Tubergen, D Feller, ... The Journal of Physical Chemistry A 114 (34), 9309-9318, 2010 | 18 | 2010 |
Infrared Spectra of 12CF212CH2 and 12CF213CH2, Quantum-Chemical Calculations of Anharmonicity, and Analyses of Resonances DC McKean, B Veken, W Herrebout, MM Law, MJ Brenner, DJ Nemchick, ... The Journal of Physical Chemistry A 114 (18), 5728-5742, 2010 | 17 | 2010 |
General internal coordinate gradient vectors and the vibrational kinetic energy operator of centrally-connected penta-atomic systems. Part I SA Manson, MM Law Physical Chemistry Chemical Physics 8 (24), 2848-2854, 2006 | 16 | 2006 |