Abstract
A new algorithm is developed to solve integral equations for simple liquids. The algorithm is based on the discrete wavelet transform of radial distribution functions. The Coifrnan 2 basis set is employed for the wavelet treatment. Using the algorithm, we have calculated structural and thermodynamic properties of a Lennard-Jones fluid in a wide range of energy and size parameters of the fluid.
Original language | English |
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Pages (from-to) | 159-162 |
Number of pages | 4 |
Journal | Journal of Molecular Liquids |
Volume | 120 |
Issue number | 1-3 |
DOIs | |
Publication status | Published - Jun 2005 |
Keywords
- Lennard-Jones fluid
- integral equation
- wavelets