Benedicte Sverdrup Ofstad

Doctoral Research Fellow - Faculty of Mathematics and Natural Sciences

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Email b.s.ofstad@kjemi.uio.no

Room V201B

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Visiting address Sem Sælands vei 26 0371 Oslo

Postal address Postboks 1033 0315 Oslo

Other affiliations Theoretical chemistry

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Academic interests

Coupled-Cluster Theory. Quantum chemistry. Programming.

Brief presentation of previous work experience and education

Dundas, Karen Oda Hjorth; Ringholm, Magnus; Ofstad, Benedicte & Cornaton, Yann (2019). SpectroscPy: Python tools for spectroscopy. Show summary
SpectroscPy is a Python script package designed to post process outputs containing response tensors from OpenRSP/LSDalton response property calculations and determine the desired spectroscopic properties. As of August 2019, it works for vibrational properties, specifically IR and Raman, but can be easily extended to other types of spectroscopies. It should also be a small task to link it to other program packages. DOI: 10.5281/zenodo.3462033

Published Nov. 30, 2016 9:47 AM - Last modified Nov. 10, 2017 12:25 PM