Worried about Eng Masters using Density Functional Theory and Career Flexibility

In summary, the individual has recently completed their undergraduate degree in Chemical Engineering and is interested in the energy field, specifically battery and storage systems. They have been offered a Masters in Materials Science and Engineering, with a focus on using Density Functional Theory to model battery materials. However, they are concerned about job prospects in this specialization and are wondering if it would be possible to work in the energy field without solely focusing on theoretical DFT modeling. They are also questioning the ease of transitioning to other technical aspects within the field and if they would still be able to obtain more general jobs. Overall, they are seeking advice on how to navigate their career path in the energy field.
  • #1
dazedand
1
0
I just finished my undergrad in Chem Eng and am very interested in energy field ( I was thinking of doing something with battery and storage systems as it is closest to my field). I was recently offered a masters in MSE for possibly working on battery materials using Density Functional Theory (the topic isn't locked down yet but the lab uses DFT for modeling).

I have recently become very worried about job prospects with such a specialization as DFT is very theoretical and I think most people end up in postdoc and heavy academic research (all theoretical). I was wondering what are possibilities of employment in industry or rather will I be able to get jobs which do not require DFT modeling but are more general modeling or design. Ideally I was hoping this would be good and interesting experience but I could work in energy field designing systems or batteries at any level without just very theoretical materials focused DFT modeling.

How easy would it be to still get a general chem or systems jobs. I would hope employer recognizes DFT means I can do good modeling and would allow me to do modeling (in still related energy field) but which doesn't necessarily use DFT. Basically how easy is it to move around in different technical aspects of a field and also is it possible to still get a more basic general job which would be given to an undergrad if need be? Thanks in advance for any advice.
 
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  • #2
To be frank: From what you describe, DFT is not something you "specialize in". DFT as used in applied research (both in chemsitry and elsewhere) is just a blackbox electronic structure tool, and for the DFT part of the applications, all you need to know is:
(1) under which circumstances which kind of DFT will give you right or wrong answers (and in particular, you need to know when dealing with a system where no DFT will give the right answer for the right reason), and
(2) which computer program to apply for which kind of system (different programs have different strengths and weaknesses).

Both of those questions are not something you need several years of training for to answer. Indeed, in almost all kinds of chemistry, such kinds of calculations are done by the experimentalists themselves nowadays, with no input from "real" theory people.
If you are worried about job prospects, going into theoretical chemistry as main subject is likely not a good idea, especialy if you do not have a strong theoretical and programming background. If you are still are interested in theory, try to go for an experimental subject where you do some theory on the side. This still allows you to sell yourself as a person who knows everything about some subject, from experiment to theory.
 

Related to Worried about Eng Masters using Density Functional Theory and Career Flexibility

1. How important is Density Functional Theory (DFT) in the field of engineering?

DFT is a widely used computational tool in the field of engineering, especially in materials science and chemical engineering. It allows for accurate predictions of the electronic structure and properties of materials, making it an essential tool for understanding and designing new materials.

2. Can DFT be used for all types of materials?

DFT is most suitable for studying materials with a large number of electrons, such as metals, semiconductors, and insulators. It may not be as accurate for materials with strong electron-electron interactions, such as transition metal compounds.

3. What are the career opportunities for someone with expertise in DFT?

There are a variety of career paths for someone with expertise in DFT, including materials research and development, computational modeling, and software development. DFT is also widely used in industries such as pharmaceuticals, energy, and electronics.

4. Is there flexibility in using DFT for different research projects?

Yes, DFT can be applied to a wide range of research projects in various fields, including chemistry, physics, and materials science. It is a versatile tool that can be adapted to different research questions and applications.

5. Are there any limitations to using DFT in engineering research?

While DFT is a powerful tool, it does have its limitations. It relies on certain assumptions and approximations, and its accuracy can be affected by factors such as system size and the choice of exchange-correlation functionals. It is important to carefully evaluate the results and consider other methods if necessary.

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