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https://www.compchem.lu.se/sites/compchem.lu.se/files/2025-10/January%2013-14.pdf

September 28th- October 2nd, 2026 Cluj-Napoca, Romania What is the school about? The school provides an overview of modern methods used to describe the ground and excited states, with a focus on multiconfigurational methods. The teaching…

https://www.compchem.lu.se/article/quantum-chemistry-excited-states-qces-2026- 2026-05-22

University of Iowa, July 13-15, 2026 What is the workshop about? This three-day (lunch-to-lunch) workshop provides an overview of modern methods for accurate theoretical descriptions of the electronic structure of solids. The focus will be…

https://www.compchem.lu.se/article/multiconfigurational-methods-electronic-structure-impurities-solids-mess-2026- 2026-05-22

LUNARC. Read more about LUNARC computing resources at Lund UniversityeSSENCE. Read more about eSSENCE, The e-Science Collaboration at Lund UniversityCOMPUTE. Read more about COMPUTE at Lund UniversityLINXS. Read more about LINXS, Institute…

https://www.compchem.lu.se/research/associated-activities- 2026-05-28

Computational Chemistry promotes the usage of X-ray and neutron scattering techniques and provides the researchers at LU with a facility where it is possible to measure and simulate macromolecules in solution and serve as an entry…

https://www.compchem.lu.se/infrastructure- 2025-03-07

https://www.compchem.lu.se/staff- 2025-01-13

Faunus Faunus is a free, object oriented library for classical molecular simulations written in C++/Python. Besides handling macromolecular solutions in various ensembles such as NVT, μVT, NPT, Faunus also covers more excotic topics such…

https://www.compchem.lu.se/infrastructure/software- 2025-01-14

In 2021 Infrastructure Call at Lund University, we were gratefully approved funding from LU Central, the Science Faculty, and the Faculty of Engineering for purchasing a Solution X-ray Scattering Instrument for Life Science and Soft Matter…

https://www.compchem.lu.se/infrastructure/biosaxs-instrument- 2025-08-29

Current vacanciesCurrent job vacancies at the Division of Computational Chemistry (Varbi)To apply for a vacant position, you need an account in Lund University’s recruitment system, Varbi.How to apply for a position (Lund University’s…

https://www.compchem.lu.se/about/job-vacancies- 2026-05-12

The 3rd National Meeting of the Swedish Chemical Society, SCS2025, takes place in Stockholm next year, June 16-18, 2025. Participants from all fields of chemistry are welcome. The program will include inspiring presentations, interactive…

https://www.compchem.lu.se/article/visit-stockholm-next-summer-scs2025-meeting-everyone-passion-chemistry- 2025-03-19

The CLIMB - Complex lipid membranes for science and technology doctoral network aims to leverage fundamental research on cell membranes to enhance the performance of lipid-based drug carriers and membrane-active drugs.Recruitment for 12…

https://www.compchem.lu.se/article/physics-chemistry-and-pharmaceutical-sciences-join-hands-msca-doctoral-network-hashtag-climb-awarded- 2025-03-19

What is the workshop about?Wavefunction methods, including multiconfigurational theory, are well-established techniques for electronic structure calculations of both ground and excited states in chemistry and molecular spectroscopy…

https://www.compchem.lu.se/article/wavefunction-methods-solid-state-matter-wfs-2025-2503-2803-2025-hotel-arkon-park-gdansk-poland- 2025-03-19

The Royal Physiographic Society of Lund has decided to award Nabanita Mandal endowments for the Natural Sciences, Medicine and Technology – Chemistry for a project on  “Unraveling Molecular Pathways of Toxic Aggregation in Amyloid Lateral…

https://www.compchem.lu.se/article/nabanita-mandal-and-gianluca-utzeri-has-been-awarded-research-grants-royal-physiographic-society- 2025-03-18

Chemical Physics Reviews from American Institute of Physics (AIP) Publishing, appointed Petter Persson, Associate Editor.Read more about the news on Chemical Physics Reviews Twitter/X @ChemPhysRev or AIP Publishing's website.

https://www.compchem.lu.se/article/chemical-physics-reviews-american-institute-physics-aip-publishing-appointed-petter-persson- 2025-03-19

Find publications in the research portalIn the Lund University Research Portal you can search for:Active researchers and doctoral students within our research areasResearch outputs, for example publicationsResearch projectsResearch…

https://www.compchem.lu.se/research/publications- 2025-01-29

Ulf RydeGrant: 600 000 SEK/ year, during 2 years.TitleDevelopment of methods to treat metal sites in ligand-binding calculationsAbstractCalculating accurate estimates for the binding affinity of small molecules (e.g. drug candidates) to a…

https://www.compchem.lu.se/article/ulf-ryde-and-valera-veryazov-received-grants-essence- 2025-03-19

TitleOptimised capacitive mixing and anomalous underscreening in salt solutionsAmount1.21MSEK PurposeEstablishment of postdoc scholarship

https://www.compchem.lu.se/article/jan-forsman-received-funds-olle-engkvists-stiftelse- 2025-03-19

The SciLifeLab research community is a dynamic, interdisciplinary network of scientists from various fields within molecular life sciences, united by the goal of addressing critical challenges in health, biodiversity, and sustainability…

https://www.compchem.lu.se/article/marie-skepo-has-been-appointed-scilifelab-group-leader- 2025-03-19

Current collaborational projects that the division of Computational Chemistry is involved in. Gdańsk-Lund Cluster: Quantum Development Potential, funded by NAWA Strategic PartnershipsThe project “Gdańsk-Lund Cluster: Quantum Development…

https://www.compchem.lu.se/research/collaborations- 2025-03-07

Physical Review B with DOI: https://doi.org/10.1103/PhysRevB.111.115103

https://www.compchem.lu.se/article/physical-review-b- 2025-03-20