KCCP - Kumpula Computational Chemistry and Physics

Welcome to the KCCP seminar series.

The upcoming seminars are seen in the list below. If you want to contribute to the seminar series, please send email to stefan.taubert -at- helsinki.fi and indicate when you want to have a talk and a (possibly preliminary) title. Please also provide a brief abstract at latest a few weeks before the seminar.

KCCP is also a course with the code CHEMS-005. Link to Sisu. To earn the credits for the course (2 credits), you should give one talk and listen to seven other seminars.

If you want to participate with a talk or if you have any questions, please be in touch with the responsible teacher, University Lecturer Stefan Taubert (Chemistry), stefan.taubert -at- helsinki.fi

Please subscribe to the email list kccp-seminar@helsinki.fi to get future updates via email about the seminar series: Send an e-mail with the content "subscribe kccp-seminar@helsinki.fi" to majordomo@helsinki.fi. You have to confirm your subscription, so check the instructions in the confirmation mail you get.

Seminars spring 2023

Time and room Speaker and title Abstract

Wed 11.1.2023
10.15-11.00
Exactum B121

Daniel Blasco Santana
Computational studies of new
supramolecular gold interactions

Link to abstract


1.3.2023

10.15-11.00
Exactum D123

Sebastian Fuyutsuki, Sophia University, Tokyo, Japan

Clumped isotope effects during C2H6 recombination/dissociation reactions calculated using ab-initio canonical transition state theory 		Link to abstract


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Seminars fall 2022 (Room D122, Exactum (16.11.: in B121))

Time Speaker and title Abstract

Wed 5.10.2022
10.15-11.00

Mesías Orozco Ic:
Properties of the molecular magnetic response in nanostructures: orbital contributions and the pseudo-pi model

Wed 12.10.2022
10.15-11.00

 Cancelled
Wed 19.10.2022
10.15-11.00

Hugo Åström:
Electronic structure calculations on quantum computers

 Link to abstract
Wed 26.10.2022
10.15-11.00		 Yavuz Dede
Quantum Chemical Modeling of Excited States,
Predictive Theoretical Studies on Boron Dipyrrin Systems 		Link to abstract
Wed 9.11.2022
10.15-11.00		 Umberto Raucci
Enhanced Sampling Aided Reaction Discovery 		Link to abstract

Wed 16.11.2022
10.15-11.00
in room B121

 Kristoffer Simula
Quantum Monte Carlo study of the optical properties of the NV center in diamond		 Link to abstract
Wed 23.11.2022
10.15-11.00		 Atif Mahmood
Porphyrin nanostructures and current densities 		Link to abstract
Wed 30.11.2022
10.15-11.00		 No Seminar
Winter School in Theoretical Chemistry this week in Chemicum A110
See Web page of the Winter School
Wed 7.12.2022
10.15-11.00		 Jeff Hammond (Nvidia)
GPU programming using C++, Fortran and Pyhton 		Link to abstract
Link to presentation