-
1
-
-
0000498792
-
-
J. A. Purton, N. L. Allan, J. D. Blundy and E. A. Wasserman, Geochim. Cosmochim. Acta, 1996, 60, 4977.
-
(1996)
Geochim. Cosmochim. Acta
, vol.60
, pp. 4977
-
-
Purton, J.A.1
Allan, N.L.2
Blundy, J.D.3
Wasserman, E.A.4
-
4
-
-
27844607149
-
-
For an overview of theoretical approaches to the modelling of phyllosilicates, see W. F. Bleam, Rev. Geophys., 1993, 31, 1.
-
(1993)
Rev. Geophys.
, vol.31
, pp. 1
-
-
Bleam, W.F.1
-
5
-
-
0003453601
-
-
ed. C. R. A. Catlow and W. C. Mackrodt, Springer-Verlag, Berlin-Heidelberg-New York, ch. 1
-
C. R. A. Catlow and W. C. Mackrodt, in Computer Simulation of Solids, ed. C. R. A. Catlow and W. C. Mackrodt, Springer-Verlag, Berlin-Heidelberg-New York, 1982, ch. 1.
-
(1982)
Computer Simulation of Solids
-
-
Catlow, C.R.A.1
Mackrodt, W.C.2
-
6
-
-
27844539138
-
-
ed. A. K. Cheetham and P. Day, Clarendon Press, Oxford, ch. 7
-
C. R. A. Catlow, in Solid State Chemistry: Techniques, ed. A. K. Cheetham and P. Day, Clarendon Press, Oxford, 1987, ch. 7.
-
(1987)
Solid State Chemistry: Techniques
-
-
Catlow, C.R.A.1
-
8
-
-
0013594172
-
-
For previous mineral simulations see, for example, M. J. Sanders, M. Leslie and C. R. A. Catlow, J. Chem. Soc., Chem. Commun., 1984, 1273;
-
(1984)
J. Chem. Soc., Chem. Commun.
, pp. 1273
-
-
Sanders, M.J.1
Leslie, M.2
Catlow, C.R.A.3
-
10
-
-
0000210018
-
-
A. Patel, G. D. Price and M. Mendelssohn, Phys. Chem. Mineral., 1991, 17, 690;
-
(1991)
Phys. Chem. Mineral.
, vol.17
, pp. 690
-
-
Patel, A.1
Price, G.D.2
Mendelssohn, M.3
-
11
-
-
0026082244
-
-
B. Winkler, M. T. Dove and M. Leslie, Am. Mineral., 1991, 76, 313;
-
(1991)
Am. Mineral.
, vol.76
, pp. 313
-
-
Winkler, B.1
Dove, M.T.2
Leslie, M.3
-
14
-
-
0021860472
-
-
C. P. Herrero, J. Sanz and J. M. Serratosa, Solid State Commun., 1985, 53, 151.
-
(1985)
Solid State Commun.
, vol.53
, pp. 151
-
-
Herrero, C.P.1
Sanz, J.2
Serratosa, J.M.3
-
17
-
-
0042327454
-
-
ed. F. Herman, W. W. Dalton and T. R. Koeler, Plenum, New York
-
A. B. Lidiard and M. J. Norgett, in Computational Solid State Physics, ed. F. Herman, W. W. Dalton and T. R. Koeler, Plenum, New York, 1972, p. 385.
-
(1972)
Computational Solid State Physics
, pp. 385
-
-
Lidiard, A.B.1
Norgett, M.J.2
-
21
-
-
37049067911
-
-
For example, D. H. Gay and A. L. Rohl, J. Chem. Soc., Faraday Trans., 1995, 91, 925.
-
(1995)
J. Chem. Soc., Faraday Trans.
, vol.91
, pp. 925
-
-
Gay, D.H.1
Rohl, A.L.2
-
22
-
-
27844459241
-
-
ed. C. R. A. Catlow and W. C. Mackrodt, Springer-Verlag, Berlin-Heidelberg-New York, ch. 16
-
For earlier work considering largely only the electrostatic contribution to the total energy, see, e.g., H. D. B. Jenkins, in Computer Simulation of Solids, ed. C. R. A. Catlow and W. C. Mackrodt, Springer-Verlag, Berlin-Heidelberg-New York, 1982, ch. 16;
-
(1982)
Computer Simulation of Solids
-
-
Jenkins, H.D.B.1
-
26
-
-
84944648082
-
-
For the ionic radii we have taken the values for six-fold coordination from R.D. Shannon, Acta Crystallogr., Sect. A, 1976, 32, 751.
-
(1976)
Acta Crystallogr., Sect. A
, vol.32
, pp. 751
-
-
Shannon, R.D.1
-
27
-
-
84981831557
-
-
2+ ions have been assumed to be 6% greater than the radii for the same ions when octahedrally coordinated.
-
(1969)
Z. Anorg. Allg. Chem.
, vol.369
, pp. 117
-
-
Babel, D.1
-
28
-
-
0003816080
-
-
Wiley, New York
-
For example, M. M. Morel and J. G. Hering, Principles and Applications of Aquatic Chemistry, Wiley, New York, 1993, p. 557.
-
(1993)
Principles and Applications of Aquatic Chemistry
, pp. 557
-
-
Morel, M.M.1
Hering, J.G.2
-
31
-
-
0028758166
-
-
S. Nishimura, S. Biggs, P. J. Scales, T. W. Healey, K. Tsunematsu and T. Tateyama, Langmuir, 1994, 10, 4554.
-
(1994)
Langmuir
, vol.10
, pp. 4554
-
-
Nishimura, S.1
Biggs, S.2
Scales, P.J.3
Healey, T.W.4
Tsunematsu, K.5
Tateyama, T.6
-
41
-
-
27844484128
-
-
M. F. Golop, A. B. Nalivken and A. Vokemenstev, SER Shrencat Natures, 1968, 22, 3.
-
(1968)
SER Shrencat Natures
, vol.22
, pp. 3
-
-
Golop, M.F.1
Nalivken, A.B.2
Vokemenstev, A.3
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