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Xiao-Gang Wang
Xiao-Gang Wang
Chemistry Department, Queen's University
Verified email at queensu.ca - Homepage
Title
Cited by
Cited by
Year
A contracted basis-Lanczos calculation of vibrational levels of methane: Solving the Schrödinger equation in nine dimensions
XG Wang, T Carrington Jr
The Journal of chemical physics 119 (1), 101-117, 2003
2112003
A nested molecule-independent neural network approach for high-quality potential fits
S Manzhos, X Wang, R Dawes, T Carrington
The Journal of Physical Chemistry A 110 (16), 5295-5304, 2006
2082006
Vibrational energy levels of CH5+
XG Wang, T Carrington Jr
The Journal of chemical physics 129 (23), 234102, 2008
1642008
New ideas for using contracted basis functions with a Lanczos eigensolver for computing vibrational spectra of molecules with four or more atoms
XG Wang, T Carrington Jr
The Journal of chemical physics 117 (15), 6923-6934, 2002
1522002
Methane line parameters in the HITRAN2012 database
LR Brown, K Sung, DC Benner, VM Devi, V Boudon, T Gabard, C Wenger, ...
Journal of Quantitative Spectroscopy and Radiative Transfer 130, 201-219, 2013
1442013
Contracted basis Lanczos methods for computing numerically exact rovibrational levels of methane
XG Wang, T Carrington Jr
The Journal of chemical physics 121 (7), 2937-2954, 2004
1372004
A symmetry-adapted Lanczos method for calculating energy levels with different symmetries from a single set of iterations
XG Wang, T Carrington Jr
The Journal of Chemical Physics 114 (4), 1473-1477, 2001
1202001
A nine-dimensional perturbative treatment of the vibrations of methane and its isotopomers
XG Wang, EL Sibert III
The Journal of chemical physics 111 (10), 4510-4522, 1999
1201999
Nitrous oxide dimer: A new potential energy surface and rovibrational spectrum of the nonpolar isomer
R Dawes, XG Wang, AW Jasper, T Carrington Jr
The Journal of chemical physics 133 (13), 134304, 2010
1112010
A finite basis representation Lanczos calculation of the bend energy levels of methane
XG Wang, T Carrington Jr
The Journal of chemical physics 118 (15), 6946-6956, 2003
1002003
Quantum states of a sextic potential: hidden symmetry and quantum monodromy
MS Child, SH Dong, XG Wang
Journal of Physics A: Mathematical and General 33 (32), 5653, 2000
882000
Six-dimensional variational calculation of the bending energy levels of HF trimer and DF trimer
XG Wang, T Carrington Jr
The Journal of Chemical Physics 115 (21), 9781-9796, 2001
862001
Computing rovibrational levels of methane with curvilinear internal vibrational coordinates and an Eckart frame
XG Wang, T Carrington Jr
The Journal of chemical physics 138 (10), 104106, 2013
832013
Theoretical and experimental studies of the infrared rovibrational spectrum of He2-N2O.
XG Wang, T Carrington Jr, J Tang, AR McKellar
The Journal of chemical physics 123 (3), 34301-34301, 2005
802005
CO Dimer: New Potential Energy Surface and Rovibrational Calculations
R Dawes, XG Wang, T Carrington Jr
The Journal of Physical Chemistry A 117 (32), 7612-7630, 2013
772013
Explicitly correlated MRCI-F12 potential energy surfaces for methane fit with several permutation invariant schemes and full-dimensional vibrational calculations
M Majumder, SE Hegger, R Dawes, S Manzhos, XG Wang, C Tucker Jr, ...
Molecular Physics 113 (13-14), 1823-1833, 2015
712015
Anharmonic force field and vibrational frequencies of tetrafluoromethane (CF4) and tetrafluorosilane (SiF4)
XG Wang, EL Sibert III, JML Martin
The Journal of Chemical Physics 112 (3), 1353-1366, 2000
712000
High resolution spectroscopic study of arsine: 3ν1 and 2ν1+ ν3 dyad: the tendency of symmetry reduction
ON Ulenikov, F Sun, X Wang, Q Zhu
The Journal of chemical physics 105 (17), 7310-7315, 1996
691996
Using monomer vibrational wavefunctions to compute numerically exact (12D) rovibrational levels of water dimer
XG Wang, T Carrington Jr
The Journal of chemical physics 148 (7), 074108, 2018
672018
The utility of constraining basis function indices when using the lanczos algorithm to calculate vibrational energy levels
XG Wang, T Carrington
The Journal of Physical Chemistry A 105 (12), 2575-2581, 2001
652001
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Articles 1–20