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Adsorption of water and formic acid molecules on the (104) surface of calcite: A theoretical study by DFT-D3

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Calcite is widely used in many fields. The synthesis of calcite is strongly influenced by the solvent and additives. In this paper, the adsorption of water and formic acid molecules... Click to show full abstract

Calcite is widely used in many fields. The synthesis of calcite is strongly influenced by the solvent and additives. In this paper, the adsorption of water and formic acid molecules...

Keywords: formic acid; water formic; adsorption water; acid molecules

Journal Title: New Journal of Chemistry
Year Published: 2023

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