Matter Modeling
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NickZ
  • Member for 3 years, 3 months
  • Last seen more than a month ago
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All Questions Answers
Score Newest
question
22
Create a new DFT functional from experimental data
Jun 30, 2020
question
18
Good books about computational chemistry of solid state materials for newbie
Jun 3, 2021
question
17
I am considering to purchase a GPU. What calculations would need FP32, and what would need FP64?
Mar 2, 2022
question
14
Are dispersion correction methods for DFT (such as D3) useful for geometry optimization?
May 7, 2021
question
12
Script to generate input files for benchmark purpose
May 23, 2021
answer
7
Which Linux distribution is best for Matter Modeling?
Jun 30, 2020
question
6
For what DFT functional is useless to add D3 or similar corrections?
Apr 2, 2022
answer
6
Is Ubuntu the best option for DFT calculations?
Jul 9, 2021
answer
6
Protein structure prediction
Jul 20, 2021
answer
5
How to extract transition density cube from .fch file in Gaussian?
Aug 12, 2021

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