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Matter Modeling
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Felix's user avatar
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Felix
  • Member for 4 years, 4 months
  • Last seen more than 2 years ago
  • Loughborough, UK
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question
16
Methods for visualising aromaticity
May 18, 2020
question
14
How do I extract a molecular structure from a CIF file?
Jul 21, 2020
question
11
Plotting of natural bond orbitals (NBOs)
Jun 17, 2020
answer
9
Plotting of natural bond orbitals (NBOs)
Jun 18, 2020
answer
9
How do I extract a molecular structure from a CIF file?
Jul 21, 2020
answer
9
How is group theory used to deduce which of these integrals are equal to 0?
Jul 28, 2020
answer
8
Inversion symmetry in 2D materials
Jul 28, 2020
answer
8
Is there a free package with robust CASSCF functionality?
May 13, 2020
answer
8
What is the difference between U(1) and O(2) symmetry?
May 18, 2020
answer
6
Parse linked frequency calculations with cclib
May 22, 2020
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7
Deleting hdf5 dataset using h5py