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A new method for the approximation of the vapor pressure-temperature function using the normal boiling point only

✍ Scribed by Dr. Klaus-Kurt Neumann; Dr. Gerhard Ostertag


Publisher
John Wiley and Sons
Year
1976
Tongue
German
Weight
101 KB
Volume
48
Category
Article
ISSN
0009-286X

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A new method to locate saddle points for
✍ I. Fdez. GalvΓ‘n; M. E. MartΓ­n; M. A. Aguilar πŸ“‚ Article πŸ“… 2004 πŸ› John Wiley and Sons 🌐 English βš– 105 KB πŸ‘ 1 views

## Abstract A new method for calculating saddle points of reactions in solution is presented. The main characteristics of the method are: (1) the solute–solvent system is described by the averaged solvent electrostatic potential/molecular dynamics method (ASEP/MD). This is a quantum mechanics/molec