Hi everyone,

just as a reminder. Tobias Kramer from Zuse-Institute Berlin will give a talk today at 2pm in the division room.

Cheers Christoph

---------- Forwarded message ----------
From: Christoph Kreisbeck <christophkreisbeck@gmail.com>
Date: 2018-01-31 9:08 GMT-08:00
Subject: Seminar Tobias Kramer: Friday 2pm-3pm
To: A-G Group <aspuru-list@lists.fas.harvard.edu>

Hi everyone,

Tobias Kramer will give a Seminar this Friday at 2pm in the division room. Please find below Tobias' title and abstract.

Cheers Christoph

Title: Bringing HEOM up-to-speed on a supercomputer

Abstract:
I present our current work to provide a scalable open quantum system dynamics using HEOM for supercomputers with hundreds of nodes. At the Zuse-Institute Berlin (ZIB) we implement the Hierarchical Equations of Motion (HEOM) method and provide utilities to compute various optical response functions. As illustration I compare computed 2D spectra with experiments of the photosynthetic apparatus of C. Tepidum [1] for various polarization sequences.

References:
[1] Tobias Kramer, Mirta Rodriguez: Two-dimensional electronic spectra of the photosynthetic apparatus of green sulfur bacteria
Scientific Reports, Vol.7, p. 45245, 2017