Matter Modeling
Pro's user avatar
Pro's user avatar
Pro's user avatar
Pro
  • Member for 2 years, 6 months
  • Last seen this week
Profile Activity
Stats
683
reputation
19k
reached
3
answers
6
questions
Communities
View all
About

I do computational chemistry, focused on non-covalent interaction. Learning Python.

Badges
View all badges
This user doesn’t have any gold badges yet.
5
silver badges
12
bronze badges
Top tags
View all tags
12
Score
1
Posts
11
Posts %
12
Score
1
Posts
11
Posts %
12
Score
1
Posts
11
Posts %
12
Score
1
Posts
11
Posts %
8
Score
3
Posts
33
Posts %
6
Score
1
Posts
11
Posts %
Top posts
All Questions Answers
Score Newest
answer
12
What are the freely available crystal-structure visualization softwares?
Mar 9, 2021
question
10
How to make a python code that can read a .xyz file and find distance, angle and dihedral angle between atoms?
Mar 3, 2021
question
8
Calculate FF interaction energy of small molecular dimers [closed]
Oct 18, 2021
question
7
How to rotate polarizability tensor depending upon the molecular coordinates?
Dec 24, 2021
question
6
Differences between DFTB3 energy and HF energy [closed]
Sep 13, 2021
answer
6
Convert XYZ coordinates to Z-matrix
Aug 3, 2021
question
3
What's the best code for getting 1-particle and 2-particle density matrices with CCSD(T) in Python?
Aug 21
question
3
Comparison between the ordering of Molecular Orbital coefficients between Gaussian and PySCF
Aug 31
answer
2
How to edit the first line of XYZ file?
Sep 7, 2021
Top network posts
View all network posts
5
Maximum number of clients reachedqt.qpa.xcb: could not connect to display :0

Your privacy

By clicking “Accept all cookies”, you agree Stack Exchange can store cookies on your device and disclose information in accordance with our Cookie Policy.