most citedA Simple Iterative Approach for Constant Chemical Potential Simulations at Interfaces

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physics.chem-ph2025★ 2 cited

A Simple Iterative Approach for Constant Chemical Potential Simulations at Interfaces

Ademola Soyemi, Khagendra Baral, Tibor Szilvasi

Chemical potential of species in solution is essential for understanding various chemical processes at interfaces. Molecular dynamics (MD) simulations, constrained by fixed composi…