Matter Modeling
Frank Jensen's user avatar
Frank Jensen's user avatar
Frank Jensen's user avatar
Frank Jensen
  • Member for 3 years, 7 months
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About

Assoc. Prof. in the Department of Chemistry, Aarhus University, Denmark. Author of the "Introduction to Computational Chemistry" textbook

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All Questions Answers
Score Newest
answer
36
Approximate equivalence table between Pople's basis sets and Jensen's DFT optimized polarization consistent basis sets (pcseg-n)
May 4, 2020
answer
15
How is Poier and Jensen's Bond Capacity Model Parameterized and Optimized?
May 14, 2020
answer
14
Hartree-Fock density vs Kohn-Sham density
Jun 9, 2020
answer
14
Basis sets optimized for CCSDT(Q) calculations
Apr 22, 2022
answer
8
What makes the inhomogeneous electron gas more interesting than its homogeneous counterpart?
Mar 8
answer
7
Does Kohn-Sham DFT use Slater determinants?
Dec 16, 2020
answer
6
Computing the rotational entropy in RRHO approximation
Apr 19
answer
6
S1-T1 energy difference in Gaussian
yesterday
answer
5
Calculate Hessian for configurations that are not at the minimum of the Potential Energy Surface
Jun 10, 2022
answer
5
What is the bond length of O2--?
Feb 8

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