UKRmol: a low-energy electron- and positron-molecule scattering suite

被引：188

作者：

Carr, J. M. ^{[1
]}

Galiatsatos, P. G. ^{[2
]}

Gorfinkiel, J. D. ^{[3
]}

Harvey, A. G. ^{[5
]}

Lysaght, M. A. ^{[3
]}

Madden, D. ^{[2
]}

Masin, Z. ^{[3
]}

Plummer, M. ^{[4
]}

Tennyson, J. ^{[2
]}

Varambhia, H. N. ^{[2
]}

机构：

[1] Univ Cambridge, Ctr Computat Chem, Univ Chem Lab, Cambridge CB2 1EW, England

[2] UCL, Dept Phys & Astron, London WC1E 6BT, England

[3] Open Univ, Dept Phys Sci, Milton Keynes MK7 6AA, Bucks, England

[4] STFC Daresbury Lab, Computat Sci & Engn Dept, Warrington WA4 4AD, Cheshire, England

[5] Max Born Inst, Div B, D-12489 Berlin, Germany

来源：

EUROPEAN PHYSICAL JOURNAL D | 2012年 / 66卷 / 03期

基金：

英国工程与自然科学研究理事会;

关键词：

DIFFERENTIAL CROSS-SECTIONS; R-MATRIX CALCULATION; DISSOCIATIVE RECOMBINATION; ROTATIONAL-EXCITATION; INTERMEDIATE ENERGIES; IMPACT DISSOCIATION; RYDBERG STATES; BOUND-STATES; COLLISIONS; PROGRAM;

D O I：

10.1140/epjd/e2011-20653-6

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

We describe the UK computational implementation of the R-matrix method for the treatment of electron and positron scattering from molecules. Recent developments in the UKRmol suite are detailed together with the collision processes it is enabling us to treat.

引用

页数：11

共 90 条

[31] Dissociative recombination in the interstellar medium and planetary ionospheres [J].

Geppert, W. D. ;

Larsson, M. .

MOLECULAR PHYSICS, 2008, 106 (16-18) :2199-2226

[32]

Golub G. H., 1996, MATRIX COMPUTATIONS

[33] Electron-H3+ collisions at intermediate energies [J].

Gorfinkiel, JD ;

Tennyson, J .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2004, 37 (20) :L343-L350

[34] Electron impact ionization of small molecules at intermediate energies:: the molecular R-matrix with pseudostates method [J].

Gorfinkiel, JD ;

Tennyson, J .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2005, 38 (11) :1607-1622

[35] Electron impact dissociative excitation of water within the adiabatic nuclei approximation [J].

Gorfinkiel, JD ;

Morgan, LA ;

Tennyson, J .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2002, 35 (03) :543-555

[36] Low-energy electron collisions with C2 using the R-matrix method [J].

Halmova, Gabriela ;

Gorfinkiel, J. D. ;

Tennyson, Jonathan .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2006, 39 (12) :2849-2860

[37] Low and intermediate energy electron collisions with the C2- molecular anion [J].

Halmova, Gabriela ;

Gorfinkiel, J. D. ;

Tennyson, Jonathan .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2008, 41 (15)

[38] Resonances in electron-impact electron detachment of C2- [J].

Halmova, Gabriela ;

Tennyson, Jonathan .

PHYSICAL REVIEW LETTERS, 2008, 100 (21)

[39] Bound and continuum states of molecular anions C2H- and C3N- [J].

Harrison, Stephen ;

Tennyson, Jonathan .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2011, 44 (04)

[40] Electron re-scattering from aligned linear molecules using the R-matrix method [J].

Harvey, A. G. ;

Tennyson, J. .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2009, 42 (09)

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