Methanol coupling in the zeolite chabazite studied via Car-Parrinello molecular dynamics

By Lo Cynthia   Giurumescu Claudiu A.   Radhakrishnan Ravi   Trout Bernhardt L.  

Molecular Physics, Vol. 102, Iss. 3, 2004-02 ,pp. : 281-288

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Molecular dynamics investigation of the inter- and intramolecular motions in liquid methanol and methanol-water mixtures

By Pálinkás G.   Bakó I.   Heinzinger K.   Bopp P.  

Molecular Physics, Vol. 73, Iss. 4, 1991-07 ,pp. : 897-915

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Effect of water-methanol content on the structure of Nafion in the sandwich model and solvent dynamics in nano-channels; a molecular dynamics study

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Molecular dynamics simulations of quadrupolar relaxation of 131 Xe in carbon tetrachloride, acetonitrile, and methanol

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Molecular Physics, Vol. 82, Iss. 3, 1994-06 ,pp. : 487-501

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Solvation properties of non-polar amino acids in water and methanol: a molecular dynamics study

By Renzi D.   Carlevaro C. M.   Stoico C.   Vericat F.  

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