q-pratz-chem
Graduate student at Quantum Theory Project, UF in @mqcomplab. My field of interest is in Electronic Structure Theory development.
University of FloridaGainesville, Florida
Pinned Repositories
Computational_Physics
Programs from Computational Physics, written in python. The reference book: Computational Physics by Mark Newman.
deep_learning
Practicum AI: Deep Learning Foundations
Elements_of_Quantum_Chemistry
Programs from Elements of Quantum Chemistry Course taught by Dr. Rodney Bartlett. The codes are written in Fortran. Theory reference book: Modern Quantum Chemistry by Szabo and Ostlund.
FanCI
Fanpy_
Fanpy is a free and open-source Python library for developing and testing multideterminant wavefunctions and related ab initio methods in electronic structure theory.
IBM_Quantum_Challenge_Fall2022
7 days journey of learning more about Qiskit Runtime, QML and Quantum Chemistry application of Quantum Computer through 4 exercises and a final challenge by IBM Quantum in Fall 2022.
Internship_VT_2019
C++ codes from summer internship 2019 (May-July) at Virginia Tech in Valeev Research Group.
Project_Interacting_Galaxies
Project to understand how close passages between galaxies affect the orbits of stars in the galaxies, and see the effects in dramatic tidal features observed in some merging galaxies. The project is done in a team of 2.
Project_MonteCarloRadiativeTransfer
My individual project on writing python code to simulate how the radiation from a star propagates through a surrounding gaseous interstellar medium along with the written report from the scientific investigation from the analysis done using the written code.
q-pratz-chem.github.io
My personal website using Chirpy Jekyll Theme.
q-pratz-chem's Repositories
q-pratz-chem/IBM_Quantum_Challenge_Fall2022
7 days journey of learning more about Qiskit Runtime, QML and Quantum Chemistry application of Quantum Computer through 4 exercises and a final challenge by IBM Quantum in Fall 2022.
q-pratz-chem/Project_MonteCarloRadiativeTransfer
My individual project on writing python code to simulate how the radiation from a star propagates through a surrounding gaseous interstellar medium along with the written report from the scientific investigation from the analysis done using the written code.
q-pratz-chem/q-pratz-chem.github.io
My personal website using Chirpy Jekyll Theme.
q-pratz-chem/Computational_Physics
Programs from Computational Physics, written in python. The reference book: Computational Physics by Mark Newman.
q-pratz-chem/deep_learning
Practicum AI: Deep Learning Foundations
q-pratz-chem/Elements_of_Quantum_Chemistry
Programs from Elements of Quantum Chemistry Course taught by Dr. Rodney Bartlett. The codes are written in Fortran. Theory reference book: Modern Quantum Chemistry by Szabo and Ostlund.
q-pratz-chem/FanCI
q-pratz-chem/Fanpy_
Fanpy is a free and open-source Python library for developing and testing multideterminant wavefunctions and related ab initio methods in electronic structure theory.
q-pratz-chem/GemCC_Data
Results from newly proposed Geminal-based Coupled Cluster wavefunctions with 1-reference orbitals for strongly correlated systems.
q-pratz-chem/Internship_VT_2019
C++ codes from summer internship 2019 (May-July) at Virginia Tech in Valeev Research Group.
q-pratz-chem/msf_2022B_day2
q-pratz-chem/Project_Interacting_Galaxies
Project to understand how close passages between galaxies affect the orbits of stars in the galaxies, and see the effects in dramatic tidal features observed in some merging galaxies. The project is done in a team of 2.
q-pratz-chem/ibm-quantum-challenge-2024
For IBM Quantum Challenge 2024 (5-14 June 2024)
q-pratz-chem/MSF_2022B_git
q-pratz-chem/periodic-table
MolSSI Bootcamp Tutorial
q-pratz-chem/pratz_qchem
✨ Build a beautiful and simple website in literally minutes. Demo at https://beautifuljekyll.com
q-pratz-chem/pycc
Rapid prototyping of coupled-cluster theories
q-pratz-chem/PyCI
A flexible ab-initio quantum chemistry library for (parameterized) configuration interaction calculations.
q-pratz-chem/Python-for-AI
q-pratz-chem/python-package-best-practices
Hands-on workshop showing good software development practices to create a Python package.
q-pratz-chem/QGSS2022
Qiskit Global Summer School 2022: Quantum Simulations by IBM Quantum. Lab assignments completed during the 2-week program.
q-pratz-chem/quantum-explorers
A self-paced, quantum computing learning journey for high school students and above.