High-pressure behavior of bikitaite: An integrated theoretical and experimental approach
Version 2 2018-01-13, 17:33
Version 1 2017-03-26, 01:57
journal contribution
posted on 2018-01-13, 17:33 authored by gloria tabacchigloria tabacchi, Orazio Ferro, Simona Quartieri, Giovanna Vezzalini, Aldo Gamba, Ettore FoisGreen open access version of the article: "High-pressure behavior of bikitaite: An integrated theoretical and experimental approach"
Published in: American Mineralogist 2002, 87(10):1415-1425
which should be cited to refer to this work
Popular summary of this article at this link: https://goo.gl/yAJ4F
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- Other chemical sciences not elsewhere classified
- Computational chemistry
- Crystallography
- Inorganic chemistry not elsewhere classified
- Nanochemistry
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- Physical properties of materials
- Theoretical quantum chemistry
- Solid state chemistry
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- Other earth sciences not elsewhere classified
- Geology not elsewhere classified
- Inorganic geochemistry
- Mineralogy and crystallography
- Condensed matter modelling and density functional theory
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Keywords
High-pressure studiesHigh-pressure XRD experimentspowder X-ray diffractionsXRPDDensity functional theorymodeling and simulationscomputational modelszeolitesnatural zeolitesporous materialswaterwater supramolecular structuresone-dimensionalHigh-Pressure Structuresfirst-principles molecular dynamicsfirst principles modelingwater wiresX-ray powder diffractionChemical Sciences not elsewhere classifiedComputational ChemistryCrystallographyInorganic Chemistry not elsewhere classifiedNanochemistry and Supramolecular ChemistryPhysical Chemistry not elsewhere classifiedPhysical Chemistry of MaterialsQuantum ChemistrySolid State ChemistryTheoretical and Computational Chemistry not elsewhere classifiedSupramolecular ChemistryEarth Sciences not elsewhere classifiedGeologyGeology not elsewhere classifiedInorganic GeochemistryMineralogyMineralogy and CrystallographyCondensed Matter Modelling and Density Functional TheoryCondensed Matter PhysicsCondensed Matter Physics not elsewhere classified
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