Job announcements relevant to people interested in electronic structure calculations…
Due to the large number of posts recently, there is currently a delay of several weeks between posts being submitted and the corresponding emails being distributed to all users. Please bear with us while we try to improve this. In the meantime – and until this notice is removed – it would assist us considerably if you could submit only important and/or urgent posts and thus help to reduce the size of the mail queue. Under no circumstances should you resend posts multiple times when you find the emails are not distributed immediately.
In light of the Russian military offensive in Ukraine, we request that announcements relating to events, jobs and other activities associated with institutions supported by the Russian and Belarusian states are not posted to the Psi-k forum.
Postdoc position: Multicomponent Real-Time TDDFT ... (No replies)
Back to Job listings...
Postdoctoral Fellow in Physics with Multicomponent Real-Time TDDFT for Application to Water
at the Department of Physics, Stockholm University. Closing date: December 20 2022.
Project description
We seek a talented and highly motivated postdoctoral fellow to work on development and implementation of efficient approaches to simultaneous real-time wave function propagation of both protons and electrons in ab initio simulations of liquid water within a TD-ADFT framework. The target is to perform fully quantum, non-Born-Oppenheimer large-scale simulations of water including also the nuclear spin-coupling between the protons in the molecules. The project is funded through an ERC Advanced Grant (GAS-WAT) and focuses on determining the character and effects of structural fluctuations in liquid water. From both experiment and theory a two-state picture of water is emerging with fluctuations between high- (HDL) and low-density (LDL) local structures at ambient conditions. To what extent the nuclear spin-coupling contributes to this is unknown.
Further information about the position can be obtained from Professor Lars G.M. Pettersson, [email protected]
https://www.su.se/english/about-the-university/work-at-su/available-jobs?rmpage=job&rmjob=p19419