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Kubicki, J. D., Blake, G. A., Apitz, S. E. (1996) Ab initio calculations on aluminosilicate Q3species; implications for atomic structures of mineral surfaces and dissolution mechanisms of feldspars. American Mineralogist, 81 (7) 789-799 doi:10.2138/am-1996-7-801

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Reference TypeJournal (article/letter/editorial)
TitleAb initio calculations on aluminosilicate Q3species; implications for atomic structures of mineral surfaces and dissolution mechanisms of feldspars
JournalAmerican Mineralogist
AuthorsKubicki, J. D.Author
Blake, G. A.Author
Apitz, S. E.Author
Year1996 (August 1)Volume81
Issue7
PublisherMineralogical Society of America
Download URLhttps://rruff.info/doclib/am/vol81/AM81_789.pdf+
DOIdoi:10.2138/am-1996-7-801Search in ResearchGate
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Mindat Ref. ID393487Long-form Identifiermindat:1:5:393487:0
GUID0
Full ReferenceKubicki, J. D., Blake, G. A., Apitz, S. E. (1996) Ab initio calculations on aluminosilicate Q3species; implications for atomic structures of mineral surfaces and dissolution mechanisms of feldspars. American Mineralogist, 81 (7) 789-799 doi:10.2138/am-1996-7-801
Plain TextKubicki, J. D., Blake, G. A., Apitz, S. E. (1996) Ab initio calculations on aluminosilicate Q3species; implications for atomic structures of mineral surfaces and dissolution mechanisms of feldspars. American Mineralogist, 81 (7) 789-799 doi:10.2138/am-1996-7-801
In(1996, August) American Mineralogist Vol. 81 (7) Mineralogical Society of America

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Sykes, Dan, Kubicki, J. D. (1996) Four-membered rings in silica and aluminosilicate glasses. American Mineralogist, 81 (3) 265-272 doi:10.2138/am-1996-3-401
Kubicki, J. D., Apitz, S. E. (1998) Molecular cluster models of aluminum oxide and aluminum hydroxide surfaces. American Mineralogist, 83 (9) 1054-1066 doi:10.2138/am-1998-9-1014
Tsatskis, I., Salje, E. K. H. (1996) Time evolution of pericline twin domains in alkali feldspars; a computer-simulation study. American Mineralogist, 81 (7) 800-810 doi:10.2138/am-1996-7-802
Kubicki, J.D., Toplis, M.J. (2002) Molecular orbital calculations on aluminosilicate tricluster molecules: Implications for the structure of aluminosilicate glasses. American Mineralogist, 87 (5) 668-678 doi:10.2138/am-2002-5-609
Kubicki, J.D., Blake, G.A., Apitz, S.E. (1997) Molecular orbital calculations for modeling acetate-aluminosilicate adsorption and dissolution reactions. Geochimica et Cosmochimica Acta, 61 (5) 1031-1046 doi:10.1016/s0016-7037(96)00399-7
Pilati, Tullio, Demartin, Francesco, Gramaccioli, Carlo Maria (1996) Lattice-dynamical evaluation of atomic displacement parameters of minerals and its implications; the example of diopside. American Mineralogist, 81 (7) 811-821 doi:10.2138/am-1996-7-803
Smrcok, Lubomir, Benco, Lubomir (1996) Ab initio periodic Hartree-Fock study of lizardite 1T. American Mineralogist, 81 (11) 1405-1412 doi:10.2138/am-1996-11-1213
Dove, Martin T., Thayaparam, S., Heine, Volker, Hammonds, Kenton D. (1996) The phenomenon of low Al-Si ordering temperatures in aluminosilicate framework structures. American Mineralogist, 81 (3) 349-362 doi:10.2138/am-1996-3-409
Andrault, D., Itie, J. P., Farges, F. (1996) High-temperature structural study of germanate perovskites and pyroxenoids. American Mineralogist, 81 (7) 822-832 doi:10.2138/am-1996-7-804
Brodholt, John, Patel, Atul, Refson, Keith (1996) An ab initio study of the compressional behavior of forsterite. American Mineralogist, 81 (1) 257-260 doi:10.2138/am-1996-1-233
Winkler, Bjoern, Blaha, Peter, Schwarz, Karlheinz (1996) Ab initio calculation of electric-field-gradient tensors of forsterite. American Mineralogist, 81 (5) 545-549 doi:10.2138/am-1996-5-602
 
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