a-CLIMAX: A new INS analysis tool

Applied Physics A: Materials Science and Processing

Volumn 74, Issue SUPPL.II, 2002, Pages

  Champion, D ^a,c   Tomkinson, J ^a   Kearley, G ^b  

^a RUTHERFORD APPLETON LABORATORY   (United Kingdom)

^b Interuniversity Reactor Institute Delft   (Netherlands)

^c UNIVERSITY OF LIVERPOOL   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPY; BENZENE; FREQUENCIES; MOLECULAR CRYSTALS; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS;

ATOMIC DISPLACEMENTS; DEBYE-WALLER EFFECTS; INTERNAL DYNAMICS;

NEUTRON SCATTERING;

EID: 0037001530     PISSN: 09478396     EISSN: None     Source Type: Journal    
DOI: 10.1007/s003390101223     Document Type: Article

References (5)

1. The a-CLIMAX program and its accompanying documentation can be downloaded from: http:///www.isis.rl.ac.uk/molecularspectroscopy/tosca and follow links to a-climax
2. A. Navarro, M. Fernandez-Gomez, J.J. Lopez-Gonzalez, M.P. Fernandez-Liences, E. Martinez-Tores, J. Tomkinson, G.J. Kearley; J. Phys. Chem A 103, 5833 (1999)
3. See: http://www.gaussian.com/ and http://www.accelrys.com/cerius2/
4. There is an extensive literature on this subject e.g. in: P.C. Painter, M.M. Coleman, J.L. Koenig: The theory of Vibrational Spectroscopy and Its application to Polymeric Materials (Wiley-Interscience 1982) Chapt. 8
5. G.A. Jeffrey, J.R. Ruble, R.K. McMullan, J.A. Pople: Proc. Roy. Soc. Lond. A 414, 47 (1987)