Frost research group (@Frost-group)
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Top repositories

1

LeadCopperApatite

Modelling the new Lead-Copper apatite proposed room temperature supeconductor
Python
31
star
2

2021-SEM-MRes-MaterialStructureAndDynamics-ComputationalWorkshop

Files from the 2021 Soft Electronic Materials MRes Computational Workshop on Material Structure and Dynamics
Jupyter Notebook
14
star
3

PolaronQMC.jl

Pigs might just fly.
Julia
6
star
4

Tethys.jl

Diagrammatic Monte-Carlo (DiagMC) calculation of Frohlich polarons. A WIP.
Julia
6
star
5

hpc-bin

Jarv's files from the HPC ~/bin
Shell
5
star
6

GPFC.jl

Julia
3
star
7

GBGA.jl

A work in progress. Graph Based Genetic Algorithm in Julia via MolecularGraph.jl
Julia
2
star
8

MolGN.jl

Molecular Graph Networks - a work in progress
Julia
2
star
9

HighThroughputNFAs

High throughput studies of NFA (Non fullerene acceptors) for organic photovoltaic and upconversion
Python
1
star
10

pathintegraldynamics

Jupyter Notebook
1
star
11

PaperOracle.jl

Scientific paper LLM enquirer; a (Julia) work in progress
Julia
1
star
12

HighThroughputPolarons

High throughput polarons with the Feynman variational approach
Python
1
star
13

PolaronDoubleTimePIMC.jl

Implementing the Imaginary and Real time path integral Monte Carlo method developed by Miladić and Vukmirović
Julia
1
star
14

Astowell.jl

Fractal fermion nodes
Julia
1
star