Network profile

Anoop A Nair

Reputation

3,343

3.5k
2.6k
1.8k

Dec
Jan
Feb
Mar

Top tag

density-functional-theory

Next privilege

3,500 Rep.

Protect questions

Badges

3

38

Newest

Nice Question

Next badge

0/1

Impact

6 posts edited

3 helpful flags

163 votes cast

Answers (28)

Votes Activity Newest

17	High-Performance Computing: What does “Mio CPUh” mean?
11	What are good resources to learn to code for matter modeling?
10	Is it possible to calculate the Curie temperature for magnetic systems?
8	Which are the freely available crystal-structure visualization softwares?
8	What is a good programming language for matter modeling?

View more →

Reputation (3,343)

+10	General Techniques for Smart Sampling in Matter Machine Learning?
+10	How can I prove that a material is ferroelectric using DFT?
+10	Which energy should I consider while trying to analyse the variation in transport coefficients with temperature?
+10	How to use the ev.x tool in Quantum ESPRESSO?

View more →

Questions (22)

Votes Activity Newest

12	Are there any codes to study magnetic materials?
11	When should “vc-relax” be performed over “relax” calculations in Quantum ESPRESSO?
11	When should spin polarized calculations be done?
10	Should I do vc-relax with nspin=2 in Quantum Espresso for magnetic samples?
10	How can I prove that a material is ferroelectric using DFT?

View more →

Tags (77)

51 density-functional-theory × 26	17 terminology
28 high-performance-computing × 3	16 k-points × 4
22 quantum-espresso × 23	16 python × 2
21 software × 5	14 reference-request × 4
18 geometry-optimization × 7	14 spin-orbit-coupling × 3

View more →

Bookmarks (12)

Votes Activity Newest Views Added

52	Is there a database where we can find previously determined geometries of materials?
26	Which are the freely available crystal-structure visualization softwares?
23	When and Why does Density Functional Theory (DFT) fail?
22	What is the appropriate way of determining a value for the Hubbard-like potential U for LDA+U / GGA+U calculations?
16	Deep Neural Networks: Are they able to provide insights for the many-electron problem or DFT?

View more →

Accounts (19)

	Matter Modeling	3,343 rep	3 silver badges38 bronze badges
	Data Science	379 rep	12 bronze badges
	Area 51	151 rep	3 bronze badges
	Cross Validated	103 rep	2 bronze badges
	Artificial Intelligence	103 rep	4 bronze badges

Badges (24)

Recent Class Name

Nice Question × 8	Organizer
Custodian × 6	Citizen Patrol
Nice Answer × 3	Commentator
Revival × 3	Critic
Necromancer × 2	Quorum

View more →

Active bounties (0)

Active Offered Earned

This user has no active bounties

Votes cast (163)

all time			by type
162	up		96	question
1	down		67	answer

Matter Modeling Stack Exchange works best with JavaScript enabled