Matter Modeling Beta
Y. Zhai
  • Member for 1 year, 5 months
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All Questions Answers
Votes Newest
15
How can I visualize the trajectory of a VASP simulation?
Oct 23 '20
14
Is there a free package with robust CASSCF functionality?
May 7 '20
13
Are dispersion correction methods for DFT (such as D3) useful for geometry optimization?
May 7
9
How can I simulate the work function given by Ultraviolet Photoelectron Spectrum (UPS)?
Nov 12 '20
8
What is the procedure for constructing an ab initio potential energy surface for CH3Cl + Ar?
Dec 25 '20
8
Alternatives to VEDA 4 vibrational energy distribution analysis software?
Jul 11 '20
6
Transformation between two different sets of molecular vibrational normal coordinate systems
Jul 1
6
Morse potential for phonons in solids instead of the harmonic potential approximation?
Sep 4 '20
5
Can I use two different codes?
Sep 4 '20
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11
Using 是不是 vs. 吗
6
Creating fillable PDFs
5
What's the difference between 主任 and 主管?

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