CHEM-E4115 - Computational Chemistry I D, Lecture, 27.2.2023-5.5.2023
This course space end date is set to 05.05.2023 Search Courses: CHEM-E4115
Monte Carlo assignment
Completion requirements
Due: Wednesday, 17 May 2023, 11:59 PM
In the assignment, the Metropolis Monte Carlo method is employed to study ion distribution in a water solution around a rigid polyelectrolyte (charged polymer) of varying charge density (varying charge/length) using a model which describes the polyelectrolyte as a rigid, hard charged cylinder and the ions as charged hard spheres. See the pdf below for specific instructions.
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- 24 April 2023, 9:18 PM