Simulation of Liquid Amides Using a Polarizable Intermolecular Potential Function
| Autor: | Dariush Habibollazadeh, Jiali Gao, Joseph J. Pavelites |
|---|---|
| Rok vydání: | 1996 |
| Předmět: |
Condensed Matter::Soft Condensed Matter
Physics::Biological Physics Quantitative Biology::Biomolecules Chemical physics Component (thermodynamics) Polarizability Chemistry Intermolecular potential General Engineering Function (mathematics) Physics::Chemical Physics Physical and Theoretical Chemistry |
| Zdroj: | The Journal of Physical Chemistry. 100:2689-2697 |
| ISSN: | 1541-5740 0022-3654 |
| DOI: | 10.1021/jp9521969 |
| Popis: | We have developed a polarizable intermolecular potential function (PIPF) for simulation of liquid amides. The PIPF potential includes a pairwise additive component, consisting of the familiar Lenna... |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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