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UW-Madison Computational Materials Group's Projects

asr_model icon asr_model

Random forest model for predicting stability and T-dependent area specific resistance of perovskite catalysts

atomtouch icon atomtouch

AtomTouch: App for Interactive Exploration of the Nanoworld

camd icon camd

Agent-based sequential learning software for materials discovery

cmg_example_model_predictions icon cmg_example_model_predictions

All models created by the Computational Materials Group (CMG) at the University of Wisconsin-Madison (UW-Madison) will reside here.

mast icon mast

MAterials Simulation Toolkit for use with pymatgen

mast-ml icon mast-ml

MAterials Simulation Toolkit for Machine Learning (MAST-ML)

mast-sey icon mast-sey

Monte Carlo Modeling of Secondary Electron Emission using fully DFT input

mns_cd icon mns_cd

This is the Cluster Dynamics code for evolution of Mn-Ni-Si in low-Cu RPV steels

model_bandgap icon model_bandgap

Random forest model to predict the electronic bandgap of materials

model_concrete icon model_concrete

Random forest model to predict the compressive strength of concrete mixtures

model_debyet_aflow icon model_debyet_aflow

Random forest model to predict the Debye temperature of materials in the AFLOW database

model_diffusion icon model_diffusion

Random forest model to predict the dilute solute activation energy for diffusion

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