The UK molecular R-matrix codes

1998 ◽  
Vol 114 (1-3) ◽  
pp. 120-128 ◽  
Author(s):  
Lesley A. Morgan ◽  
Jonathan Tennyson ◽  
Charles J. Gillan
Keyword(s):  
R Matrix ◽  
2012 ◽  
Vol 388 (6) ◽  
pp. 062015
Author(s):  
I R Wasson ◽  
C A Ramsbottom ◽  
M P Scott ◽  
C P Ballance

2006 ◽  
Vol 174 (4) ◽  
pp. 273-356 ◽  
Author(s):  
Oleg Zatsarinny
Keyword(s):  
R Matrix ◽  
B Spline ◽  

Atoms ◽  
2021 ◽  
Vol 9 (3) ◽  
pp. 62
Author(s):  
Mehdi Ayouz ◽  
Alexandre Faure ◽  
Jonathan Tennyson ◽  
Maria Tudorovskaya ◽  
Viatcheslav Kokoouline

Cross-sections and thermally averaged rate coefficients for vibration (de-)excitation of a water molecule by electron impact are computed; one and two quanta excitations are considered for all three normal modes. The calculations use a theoretical approach that combines the normal mode approximation for vibrational states of water, a vibrational frame transformation employed to evaluate the scattering matrix for vibrational transitions and the UK molecular R-matrix code. The interval of applicability of the rate coefficients is from 10 to 10,000 K. A comprehensive set of calculations is performed to assess uncertainty of the obtained data. The results should help in modelling non-LTE spectra of water in various astrophysical environments.


1995 ◽  
Vol 92 (2-3) ◽  
pp. 290-420 ◽  
Author(s):  
Keith A. Berrington ◽  
Werner B. Eissner ◽  
Patrick H. Norrington
Keyword(s):  
R Matrix ◽  

2017 ◽  
Author(s):  
Helmut Leeb ◽  
Paraskevi Dimitriou ◽  
Ian J. Thompson

Atoms ◽  
2018 ◽  
Vol 6 (3) ◽  
pp. 49 ◽  
Author(s):  
Marjan Khamesian ◽  
Mehdi Ayouz ◽  
Jasmeet Singh ◽  
Viatcheslav Kokoouline

Cross sections for rotational excitation and de-excitation of the HeH+ ion by an electron impact are computed using a theoretical approach that combines the UK R-matrix code and the multi-channel quantum defect theory. The thermally-averaged rate coefficients derived from the obtained cross sections are fitted to an analytical formula valid for a wide range of temperatures.


2000 ◽  
Vol 111 (1) ◽  
pp. 78-90 ◽  
Author(s):  
C. R. M. Hay ◽  
T. P. Baglin ◽  
P. W. Collins ◽  
F. G. H. Hill ◽  
D. M. Keeling

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