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Chemistry
Meta User
Network Profile
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1
6
24

logical x 2

Apparently, this user prefers to keep an air of mystery about them.

36
answers
26
questions
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  • Member for 3 years, 4 months
  • 272 profile views
  • Last seen Jan 1 at 19:18

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Score 36
Posts 27
Posts % 44
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Top Posts (62) All Questions Answers | Votes Newest

20 What are modern approaches to describe and/or quantify aromaticity? Dec 2 '16
11 What equipment is used for two-dimensional IR spectroscopy and how can the molecular structure of a compound be resolved? Oct 19 '16
10 Boltzmann Distribution in Molecular Dynamics Simulation? Sep 15 '17
10 How to perform molecular dynamics simulations of charged systems? Feb 21 '17
10 Do non-ergodic chemical reactions exist? Oct 15 '17
9 Would cerium(III) in solution be oxidized to cerium(IV) in ESI mass spectroscopy? Oct 2 '17
8 How to specify a different isotope in the ORCA quantum chemistry program? Nov 30 '16
8 NMR calculations with NWChem quantum chemistry program Nov 17 '16
7 What is the rotational symmetry number used to calculate the rotational entropy from an ORCA frequency calculation? Nov 16 '16
7 How are the angle bending parameters defined in the MM2 force field? Sep 12 '17
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