Matter Modeling
QMlab's user avatar
QMlab's user avatar
QMlab's user avatar
QMlab
  • Member for 2 years, 10 months
  • Last seen more than 1 year ago
  • Canada
Profile Activity
Stats
946
reputation
7k
reached
8
answers
3
questions
Communities
View all
About

I am computational chemistry.

Badges
View all badges
This user doesn’t have any gold badges yet.
3
silver badges
12
bronze badges
Top tags
View all tags
32
Score
8
Posts
73
Posts %
17
Score
2
Posts
18
Posts %
13
Score
1
Posts
9
Posts %
13
Score
1
Posts
9
Posts %
13
Score
1
Posts
9
Posts %
10
Score
1
Posts
9
Posts %
Top posts
View all questions and answers
All Questions Answers
Score Newest
question
16
Do eigenvalues in DFT mean anything?
May 16, 2020
question
16
Hartree-Fock density vs Kohn-Sham density
Jun 9, 2020
answer
13
What are some recent developments in density functional theory?
Jun 6, 2020
answer
10
When and Why does Density Functional Theory (DFT) fail?
Jun 7, 2020
question
7
Is there a relation between self-interaction errors and integer-discontinuities in Kohn-Sham-DFT?
Jun 10, 2020
answer
5
How to incorporate the effect of spin-orbit coupling in electronic structure calculation
Jun 9, 2020
answer
4
Do eigenvalues in DFT mean anything?
Jun 6, 2020
answer
4
Is there an example where TD-DFT fails to provide sufficient accuracy for a small system, where RI-CC2 is sufficient?
Jun 10, 2020
answer
4
What programs can do electron integrals and SCF calculations with more than one CPU?
Jun 15, 2020
answer
3
Physically motivated double hybrid DFT?
Jun 10, 2020

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.