Matter Modeling
Hitanshu Sachania's user avatar
Hitanshu Sachania's user avatar
Hitanshu Sachania's user avatar
Hitanshu Sachania
  • Member for 3 years, 7 months
  • Last seen this week
Profile Activity

10 Answers

Score Activity Newest
17 votes

How big should a supercell be in phonon calculations?

12 votes

Can ab initio crystal structure methods predict the structure of cuprates from their stoichiometry and quantify the brittleness of those materials?

10 votes
Accepted

How to calculate Special Quasirandom Structure with local ordering?

10 votes

Create doped structures to POSCAR files for vasp

10 votes

Is it possible to calculate the Curie temperature for magnetic systems?

7 votes

Suggestions for a good crystal structure visualization workflow

3 votes

How to analyze the space group of a relaxed structure that has fractional site occupancies

3 votes
Accepted

Vacancy with USPEX

2 votes

Cluster correlations for a perfectly random state in the Alloy Theoretic Automated Toolkit

1 vote

Generating special quasirandom structures (SQS) for surface calculations?

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