Structural, vibrational and thermophysical properties of pyrophyllite by semi-empirical density functional modelling

Author:

Ulian Gianfranco,Valdrè Giovanni

Publisher

Springer Science and Business Media LLC

Subject

Geochemistry and Petrology,General Materials Science

Reference63 articles.

1. Alimdzhanova DI, Ismatov AA, Ganieva MM (1999) The effect of quartz-pyrophyllite raw material on porcelain structure formation. Glass Ceram 56:61–63

2. Anderson OL (1995) Equation of state of solids for geophysics and ceramic science. Oxford University Press, New York, p 405

3. Angel RJ (2001) EOS-FIT6.0. Computer program ( http://www.rossangel.com )

4. Bailey SW (1988) Introduction, hydrous phyllosilicates. Rev Mineral Geochem 19:1–8

5. Becke AD (1993) Density-functional thermochemistry. 3. The role of exact exchange. J Chem Phys 98:5648–5652

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