| Reference Type | Journal (article/letter/editorial) |
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| Title | Computer simulation of aqueous pore fluids in 2:1 clay minerals |
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| Journal | Mineralogical Magazine | ISSN | 0026-461X |
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| Authors | Skipper, N. T. | Author |
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| Year | 1998 (October) | Volume | 62 |
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| Issue | 5 |
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| Publisher | Mineralogical Society |
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| Download URL | https://rruff.info/doclib/MinMag/Volume_62/62-5-657.pdf+ |
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| DOI | doi:10.1180/002646198548043Search in ResearchGate |
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| Generate Citation Formats |
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| Mindat Ref. ID | 319 | Long-form Identifier | mindat:1:5:319:9 |
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| GUID | 0 |
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| Full Reference | Skipper, N. T. (1998) Computer simulation of aqueous pore fluids in 2:1 clay minerals. Mineralogical Magazine, 62 (5) 657-667 doi:10.1180/002646198548043 |
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| Plain Text | Skipper, N. T. (1998) Computer simulation of aqueous pore fluids in 2:1 clay minerals. Mineralogical Magazine, 62 (5) 657-667 doi:10.1180/002646198548043 |
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| Abstract/Notes | AbstractMonte Carlo and molecular dynamics computer simulations are now able to provide detailed information concerning the structure, dynamics, and thermodynamics of pore fluids in 2:1 clays. This article will discuss interparticle interaction potentials currently available for atomistic simulations of clay-water systems, and will describe how computational techniques can be applied to modelling of clay systems. Some recent simulation studies of 2:1 clay hydration will then be reviewed. Comparison with experimental data promotes confidence in the molecular models and simulation techniques, and points to exciting future prospects. |
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