-
5
-
-
11944249966
-
-
Sarnthein, J.; Pasquarello, A.; Car, R. Phys. Rev. Lett. 1995, 74, 4682.
-
(1995)
Phys. Rev. Lett
, vol.74
, pp. 4682
-
-
Sarnthein, J.1
Pasquarello, A.2
Car, R.3
-
6
-
-
4243606416
-
-
Sarnthein, J.; Pasquarello, A.; Car, R. Phys. Rev. B 1995, 52, 12690.
-
(1995)
Phys. Rev. B
, vol.52
, pp. 12690
-
-
Sarnthein, J.1
Pasquarello, A.2
Car, R.3
-
7
-
-
0035624908
-
-
Benoit, M.; Ispas, S.; Tuckerman, M. E. Phys. Rev. B 2001, 64, 224205.
-
(2001)
Phys. Rev. B
, vol.64
, pp. 224205
-
-
Benoit, M.1
Ispas, S.2
Tuckerman, M.E.3
-
8
-
-
0037049663
-
-
Trave, A.; Tangney, P.; Scandolo, S.; Pasquarello, A.; Car, R. Phys. Rev. Lett. 2002, 89, 245504.
-
(2002)
Phys. Rev. Lett
, vol.89
, pp. 245504
-
-
Trave, A.1
Tangney, P.2
Scandolo, S.3
Pasquarello, A.4
Car, R.5
-
9
-
-
34848838311
-
-
Karki, B. B.; Bhattarai, D.; Stixrude, L. Phys. Rev. B 2007, 76, 104205.
-
(2007)
Phys. Rev. B
, vol.76
, pp. 104205
-
-
Karki, B.B.1
Bhattarai, D.2
Stixrude, L.3
-
14
-
-
0032005717
-
-
Rustad, J. R.; Wasserman, E.; Felmy, A. R.; Wilke, C. J. Colloid Interface Sci. 1998, 198, 119.
-
(1998)
J. Colloid Interface Sci
, vol.198
, pp. 119
-
-
Rustad, J.R.1
Wasserman, E.2
Felmy, A.R.3
Wilke, C.4
-
15
-
-
0035909763
-
-
van Duin, A. C. T.; Dasgupta, S.; Lorant, F.; Goddard, W. A. J. Phys. Chem. A 2001, 105, 9396.
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 9396
-
-
van Duin, A.C.T.1
Dasgupta, S.2
Lorant, F.3
Goddard, W.A.4
-
16
-
-
0037714495
-
-
van Duin, A. C. T.; Strachan, A.; Stewman, S.; Zhang, Q.; Xu, X.; Goddard, W. A. J. Phys. Chem. A 2003, 107, 3803.
-
(2003)
J. Phys. Chem. A
, vol.107
, pp. 3803
-
-
van Duin, A.C.T.1
Strachan, A.2
Stewman, S.3
Zhang, Q.4
Xu, X.5
Goddard, W.A.6
-
17
-
-
9644273884
-
-
Kuzuu, N.; Yoshie, H.; Tamai, Y.; Wang, C. J. Non-Cryst. Solids 2004, 349, 319.
-
(2004)
J. Non-Cryst. Solids
, vol.349
, pp. 319
-
-
Kuzuu, N.1
Yoshie, H.2
Tamai, Y.3
Wang, C.4
-
18
-
-
55149113073
-
-
Anderson, K. E.; Grauvilardell, L. C.; Hirschmann, M. C.; Siepmann, J. I. J. Phys. Chem. B 2008, 112, 13015.
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 13015
-
-
Anderson, K.E.1
Grauvilardell, L.C.2
Hirschmann, M.C.3
Siepmann, J.I.4
-
23
-
-
0036306195
-
-
Hudon, P.; Jung, I.-H.; Baker, D. H. Phys. Earth Planet. Mater. 2002, 130, 159.
-
(2002)
Phys. Earth Planet. Mater
, vol.130
, pp. 159
-
-
Hudon, P.1
Jung, I.-H.2
Baker, D.H.3
-
27
-
-
0002322473
-
-
Nicholls, J, Russell, K, Eds, Mineralogical Society of America: Washington
-
Lange, R. A.; Carmichael, I. S. E. In Reviews in Mineralogy: Modern Methods of Igneous Petrology; Nicholls, J., Russell, K., Eds.; Mineralogical Society of America: Washington, 1990; Vol. 24, pp 25-64.
-
(1990)
Reviews in Mineralogy: Modern Methods of Igneous Petrology
, vol.24
, pp. 25-64
-
-
Lange, R.A.1
Carmichael, I.S.E.2
-
31
-
-
1642352721
-
-
Liu, Y.; Behrens, H.; Zhang, Y. X. Am. Mineral. 2004, 89, 277.
-
(2004)
Am. Mineral
, vol.89
, pp. 277
-
-
Liu, Y.1
Behrens, H.2
Zhang, Y.X.3
-
32
-
-
84906391525
-
-
Alternatively, the equilibrium constants were also calculated using the oxygen species listed in Table 3. In this case, it was assumed that oxygen atoms that are connected to 1 H atom and 1 or 2 Si atoms contribute to [OH melt, that oxygen atoms that are connected to 2 H atoms and 0 or 1 Si atom contribute to [H2Omelt, and that all other oxygen species (including isolated hydroxide fragments) do not contribute to either the peak at 4500 or 5200 cm-1 and hence are part of [O melt, Using this approach. In K, 1.3 ± 1.0 and 1.5 ± 0.5 for system 10W at 2000 and 3000 K, respectively. However, at higher temperatures, the In K values are more scattered and are generally lower than those found by searching for the two nearest-neighbor atoms of each oxygen atom
-
melt]. Using this approach. In K = 1.3 ± 1.0 and 1.5 ± 0.5 for system 10W at 2000 and 3000 K, respectively. However, at higher temperatures, the In K values are more scattered and are generally lower than those found by searching for the two nearest-neighbor atoms of each oxygen atom.
-
-
-
-
33
-
-
42549110417
-
-
Mookherjee, M.; Stixrude, L.; Karki, B. Nature 2008, 452, 983.
-
(2008)
Nature
, vol.452
, pp. 983
-
-
Mookherjee, M.1
Stixrude, L.2
Karki, B.3
|