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Fowler, Sarah J., Sherman, David M., Brodholt, John P., Lord, Oliver T. (2024) Mineral–water reactions in Earth’s mantle: Predictions from Born theory and ab initio molecular dynamics. Geochimica et Cosmochimica Acta, 372. 111-123 doi:10.1016/j.gca.2024.03.012

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Reference TypeJournal (article/letter/editorial)
TitleMineral–water reactions in Earth’s mantle: Predictions from Born theory and ab initio molecular dynamics
JournalGeochimica et Cosmochimica Acta
AuthorsFowler, Sarah J.Author
Sherman, David M.Author
Brodholt, John P.Author
Lord, Oliver T.Author
Year2024 (May)Volume372
PublisherElsevier BV
DOIdoi:10.1016/j.gca.2024.03.012Search in ResearchGate
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Mindat Ref. ID17241777Long-form Identifiermindat:1:5:17241777:8
GUID0
Full ReferenceFowler, Sarah J., Sherman, David M., Brodholt, John P., Lord, Oliver T. (2024) Mineral–water reactions in Earth’s mantle: Predictions from Born theory and ab initio molecular dynamics. Geochimica et Cosmochimica Acta, 372. 111-123 doi:10.1016/j.gca.2024.03.012
Plain TextFowler, Sarah J., Sherman, David M., Brodholt, John P., Lord, Oliver T. (2024) Mineral–water reactions in Earth’s mantle: Predictions from Born theory and ab initio molecular dynamics. Geochimica et Cosmochimica Acta, 372. 111-123 doi:10.1016/j.gca.2024.03.012
In(2024) Geochimica et Cosmochimica Acta Vol. 372. Elsevier BV

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Fowler, Sarah Jane, Sherman, David M. (2020) The nature of NaCl–H2O deep fluids from ab initio molecular dynamics at 0.5–4.5 GPa, 20–800 °C, and 1–14 m NaCl. Geochimica et Cosmochimica Acta, 277. 243-264 doi:10.1016/j.gca.2020.03.031
Sherman, David M. (2007) Complexation of Cu+ in Hydrothermal NaCl Brines: Ab initio molecular dynamics and energetics. Geochimica et Cosmochimica Acta, 71 (3) 714-722 doi:10.1016/j.gca.2006.09.015
Mei, Yuan, Sherman, David M., Liu, Weihua, Brugger, Joël (2013) Ab initio molecular dynamics simulation and free energy exploration of copper(I) complexation by chloride and bisulfide in hydrothermal fluids. Geochimica et Cosmochimica Acta, 102. 45-64 doi:10.1016/j.gca.2012.10.027
Peacock, Caroline L., Sherman, David M. (2005) Erratum to Caroline L. Peacock and David M. Sherman (2004) “Copper(II) sorption onto goethite, hematite, and lepidocrocite: A surface complexation model based on ab initio molecular geometries and EXAFS spectroscopy”, Geochimica et Cosmochimica Acta 68, 2623–2637. Geochimica et Cosmochimica Acta, 69 (21) 5141-5142 doi:10.1016/j.gca.2005.02.020
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