pKa of silicic acid in presence of La3+ using single sweep method coupled to DFT-based molecular dynamics.

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https://hal.archives-ouvertes.fr/hal-00918858
Contributor : Riccardo Spezia <>
Submitted on : Sunday, December 15, 2013 - 6:36:45 PM
Last modification on : Thursday, March 21, 2019 - 2:52:17 PM

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  • HAL Id : hal-00918858, version 1

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Riccardo Spezia, Rodolphe Vuilleumier. pKa of silicic acid in presence of La3+ using single sweep method coupled to DFT-based molecular dynamics.. Molecular Physics, Taylor & Francis, 2013, 111, pp.3478-3485. ⟨hal-00918858⟩

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