Theoretical Chemistry PhD Student interested in molecular liquids and solvation properties
Email: [email protected]
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University of Strathclyde
- Glasgow, Scotland
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23:23
(UTC) - @2AUK_C
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Fast and flexible nonadiabatic molecular dynamics in Julia!
The fastest tropical matrix multiplication in the world!
Package to handle integrals over Gaussian-type atomic orbitals.
Quantum-chemistry methods in Julia. Based on Rick Muller's PyQuante2
A generic and fast solver of mode-coupling theory-like integrodifferential equations
A generic solver for Ornstein-Zernike equations from liquid state theory
Julia library that provides routines to calculate the structure factor of liquids