Python library written in C++ for calculation of local atomic structural environment
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Updated
Sep 4, 2024 - C++
Python library written in C++ for calculation of local atomic structural environment
PyGL: statistical field theory in Python. github.com/rajeshrinet/pygl
A Python package describing Stochastic Nucleation of Water in vials
Interactive simulation of the Ising model with GUI and different algorithms
Code and data for Phase Field Nucleation Benchmark written in Julia language. Repository corresponds to the results in "On the Effect of Nucleation Undercooling on Phase Transformation Kinetics" in IMMI Journal in 2022
Austenite-ferrite TransModel 2.0 for predicting austenite-ferrite phase transformations in low-alloyed steels during continuous cooling, isothermal or thermal cycling using a Gibbs energy balance approach.
Austenite-ferrite TransModel 1.0 for predicting austenite-ferrite phase transformations in Fe-C-Mn alloys during continuous cooling under a mixed-mode interfacial condition.
Slides for various presentations I held in the last few years
This is a Python package for classifying DAmFRET data based on supervised learning. The data can also be analyzed to allow mechanistic inferences regarding nucleation of ordered assemblies.
Implementation of the PFHub Benchmarks on Nucleation using MMSP
Multistep nucleation compatible with a single energy barrier: catching the non-classical culprit
Molecular Dynamics Data Processor for Nucleation
CellAutomaton
Surface nucleation module to fit enthalpy - time measurements
Package for computing secondary nucleation constants from DSC measurements Enthalpy vs time
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