1.021/3.021/10.333/22.00  Intro to Modeling & Simulation

Lecture 12 is up

Dear Class,

In our lecture, we discuss some examples of models without physics!

R

Announced on 07 May 2020  6:54  p.m. by Rafael Gomez-Bombarelli

Lecture 11 is up

Dear Class,

As we enter the home straight for the semester (and the weather finally improves!) we look into machine learning and statistical approaches to modeling and simulations.

R

Announced on 05 May 2020  5:53  p.m. by Rafael Gomez-Bombarelli

Problem set 6 - optional

Dear Class,

An optional probelm set 6 has been posted on Stellar. This is on DFT of periodic systems.

Enjoy!
Kai

Announced on 05 May 2020  12:14  p.m. by Kai Guo

Recitation 9 and survey for Part II: Lecture 9

Dear Class,

The slides and video for the final recitation (#9) of this course have been uploaded. It is about perioic DFT simulations using Quantum Espresso and this tool will be used for the final pset (#6, optional). Let me know if you have any questions!

Also, please find the questions and survey for the lectures 9 of Part II via the link below:
https://forms.gle/RPpXr3cwxZvwohCi7

Best regards,
Kai Guo

Announced on 02 May 2020  12:17  a.m. by Kai Guo

Lecture 10 is up

Hi All,
Today we have discussed how to figure out the splicing and slicing of your simulations so they run effectively in the available hardware.

Happy weekend!

R

Announced on 30 April 2020  7:56  p.m. by Rafael Gomez-Bombarelli