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Thelonious's Projects

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做自己的读书笔记

a-arm icon a-arm

a-ARM: Automatic Rhodopsin Modeling with Ionization State Selection, Counter-ion Placement and Chromophore Cavity Generation

brief-foray-into-qm icon brief-foray-into-qm

A collection of notebooks outlining introductory computational quantum mechanical concepts. Notebooks include a visualization of the orbitals of Hydrogen, a simple Hartee Fock implementation, and ground state energy calculations for Hydrogen and a square potential well using the variational principle.

chpc-nithep-summer-school-2021 icon chpc-nithep-summer-school-2021

Jupyter notebooks for a tutorial/computational part of mini-series on "Foundations of Theoretical and Computational Open Quantum Systems"

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Course of Computing Methods in Physics

computational-quantum-dynamics icon computational-quantum-dynamics

Repository to organize code and exercises for the lecture course on "Computional Quantum Dynamics" held by Dr. M. Gärttner I attended at Heidelberg University during the winter term 2018/2019.

deepchem icon deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

ml-ditp-attp icon ml-ditp-attp

Machine Learning: a New Toolbox for Theoretical Physics (Advanced Topics in Theoretical Physics course)

phys-3210 icon phys-3210

PHYS 3210: Computational Techniques in Physics

qed2_ht_code icon qed2_ht_code

This code accompanies my master's thesis, “Hamiltonian Truncation Methods in Two-dimensional Quantum Electrodynamics.”

quantum_heom icon quantum_heom

A tool to model the bath relaxation dynamics of open quantum systems by Lindblad and Hierarchical Equations of Motion (HEOM) approaches.

qulapeno icon qulapeno

Tutorials for a mini course in machine learning and quantum physics

se_solution_ci_2dpot icon se_solution_ci_2dpot

A program to solve Schrodinger equation around conical intersection using discontinuous basis set in adiabatic representation

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