Matter Modeling
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Hitanshu Sachania
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Materials modelling. Undergrad: Chemical engineering. Postgrad: Materials engineering.

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All Questions Answers
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question
19
What do phonon dispersion (or lattice dynamics) studies include?
May 3, 2020
question
18
What do negative phonon frequencies signify?
Oct 29, 2020
question
17
On the nature of zero-point energy (ZPE)
Oct 31, 2020
question
16
k-points convergence for special quasirandom structures (SQS) of the same material containing different # of atoms
Apr 29, 2020
answer
15
How big should a supercell be in phonon calculations?
Jul 8, 2020
question
14
What does it mean to say a material is 'anharmonic'?
Nov 22, 2020
question
14
How to differentiate similar clusters in the mcsqs output in ATAT?
Oct 12, 2020
question
14
Determining Fermi energy in density functional theory
Oct 14, 2020
question
13
Phonon density of states in statistical thermodynamics
Nov 3, 2020
question
13
Ion-ion interaction potential in Kohn-Sham DFT
Dec 29, 2020
Top Meta posts
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13
Can we refrain from using 'dft' as a tag for density functional theory?
5
Can we ask code specific questions?
4
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What do the commas in "${var,,}" mean?
5
How to print an nth column in a file using awk?

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