Ankur Taya

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Questions related from Ankur Taya

Which machine learning tools, libraries, and frameworks are commonly used in materials science research?

Are there any specific libraries that are well-suited for dealing with materials data?

31 July 2023 1,649 4 View

What are the prominent areas within materials science where machine learning has shown promising results?

What are the prominent areas within materials science where machine learning has shown promising results? I am particularly interested in applications related to material property prediction,...

31 July 2023 472 3 View

What are the typical machine learning models employed in materials science research?

What are the typical machine learning models employed in materials science research? Are there any preferred algorithms or models that tend to work well in this domain?

31 July 2023 2,997 4 View

What are the good sources for ML in materials science?

Are there any specific books, courses, or online resources that you would recommend to someone starting their journey in machine learning for materials science? I would greatly appreciate any...

31 July 2023 1,646 3 View

What are the main challenges or pitfalls one should be aware of when applying machine learning in materials science?

What are the main challenges or pitfalls one should be aware of when applying machine learning in materials science? How can we overcome these challenges effectively?

31 July 2023 780 5 View

How to calculate the value of band edges using VASP/WIEN2k for band alignment in perovskite solar cells?

Hi everyone! I want to show band alignment of a hybrid halide perovskite material with an electron transport material ( Fig: CH3NH3PBI3 and TiO2, respectively). The position of VB edge (-5.4...

20 June 2018 1,372 8 View

How electron effective mass is calculated using curve fitting method?

Dear all, In band-structure of a compound and I know E-k values of the band containing Conduction band minima (CBM). Can anyone tell me the procedure for calculating the effective mass of the...

20 June 2018 4,761 4 View