Chemistry
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Jan Jensen

I am a computational chemist at the University of Copenhagen

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27 Why do n AOs only form n MOs? Sep 19 '17
17 What do the quantum numbers actually signify? May 18 '15
15 How to calculate wavenumbers of normal modes from the eigenvalues of the Cartesian force constant matrix? May 17 '17
15 What is the origin of the maximum in rotational heat capacity? May 17 '15
14 Why does HCN boil at a higher temperature than NH3? May 23 '15
14 What is it that is “symmetry-adapted” about symmetry-adapted perturbation theory? Aug 22 '17
12 Is there a way to experimentally measure entropy? Dec 12 '15
12 Quantum mechanical explanation for Le Chatelier's principle? Jun 11 '15
10 How to evaluate the heat of formation with computational chemistry? Sep 8 '15
10 Why can there not be more than one sigma bond in a set of bonds? Jun 6 '15
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