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Experimentation with different thermodynamic cycles used for pKa calculations on carboxylic acids using complete basis set and Gaussian-n models combined with CPCM continuum solvation methods
Matthew D. Liptak, George C. ShieldsVolume:
85
Year:
2001
Language:
english
Pages:
15
DOI:
10.1002/qua.1703
File:
PDF, 175 KB
english, 2001