Lars Goerigk
@lgoer_compchem
Followers
3K
Following
8K
Media
173
Statuses
3K
Associate Professor, @ChemistryUoM @scimelb @unimelb; Associate Editor @PCCP #theochem #compchem #ozchem (views are my own) (he/him)
Melbourne, Victoria
Joined June 2015
I'm very excited about joining the Editorial Board of @PCCP as an Associate Editor #compchem #ozchem
rsc.org
The journal for high quality research in physical chemistry, chemical physics and biophysical chemistry.
5
3
74
Very pleased to have been able to make a small contribution to this Edge Article in @ChemicalScience led by Dr Chris Ritchie @MonashUni "Planarisation or a twist? Using steric engineering to unlock the origin of mechanofluorochromic red-shifts" #ozchem
pubs.rsc.org
Engineering the ground-state orientations of donor and acceptor groups through steric control of fluorophore conformations is an effective strategy for manipulating molecular electronics and, in...
0
1
10
Blazing-fast image creation – using just your voice. Try Grok Imagine.
262
502
3K
Rare gas excimers and exciplexes are quite tricky for TD-DFT methods. Read more in the upcoming Polyhedron special issue to celebrate the centenary of John Pople's birth. Congratulations to everyone involved incl. @ariel_cjones.#compchem #ozchem
0
2
14
Congratulations to @ariel_cjones who won one of the prizes for the best talk at the Australian Winter School in Computational Chemistry in Kiama, NSW.
0
3
4
Hello from the LEGO shop in Copenhagen. I found myself a recreational activity for my office for when I’m back
0
0
4
A solution to the TD-DFT overestimation problem for electronic excitation energies in BODIPYs (incl. predictions and exp. verification). Our new paper is out now:
pubs.rsc.org
It has been established in the literature that time-dependent density functional theory (TD-DFT) methods systematically overestimate the electronic excitation energies in boron-dipyrromethene...
0
4
24
An amazing byproduct of going to WATOC2025 is to be able to attend Oslo Pride the next day.
0
1
11
And thus ends an amazing #watoc2025 in beautiful Oslo. 6 great days full.of wonderful advances and applications in Theoretical and Computational Chemistry. Can’t wait for #watoc2028 in Mérida, Mexico.
0
2
32
RT @MSFTResearch: Microsoft researchers achieved a breakthrough in the accuracy of DFT, a method for predicting the properties of molecules….
0
100
0
APATCC-11 in Kobe was great. Our research was presented in 2 talks and 3 posters, including Quyen’s first talk at a big conference. Can’t wait for APATCC-12 in Chiang Mai in 2027
0
3
13
My response to the transphobic flyer the Australian “Christian” Lobby placed in Brunswick letter boxes today. 🤮
0
0
5
RT @FrancesBiophys: Awardees of the IUPAC 2025 Distinguished Women in Chemistry or Chemical Engineering #WomenInScience #chemistry https:/….
0
1
0
RT @jppiquem: #compchem Good read: Good Practices in Database Generation for Benchmarking Density Functional Theory
wires.onlinelibrary.wiley.com
Advancements in DFT over the past three decades have been driven by extensive benchmarking studies. This review outlines best practices in database generation, offering guidance on key methodologic...
0
22
0
Congratulations to Haseena Ismail on her first PhD paper! .Tricky to figure out the Co redox & spin state variation & ligand redox & protonation variation. #RadicalLigands #SpinCrossover.#OzChem #SQUIDForUnimelb 🦑🧲.
0
2
10
RT @ChemistryUoM: Amazing work from Professor Evan Bieske and his team.
linkedin.com
Our researchers are replicating the cold vacuum of space to study how interstellar molecules are produced and what they're made of. This research does more than analyse meteorites, we're looking at...
0
1
0
RT @FrancesBiophys: Chemist Martin Karplus dies at 94: Nobel laureate developed first molecular dynamics simulation of a biomolecule. He de….
cen.acs.org
The Nobel laureate developed the first molecular dynamics simulation of a biomolecule
0
2
0
RT @keex0003: Job opportunity - my department has an open position in medicinal chemistry. Join us and be my colleague! Apply using the li….
0
7
0
Happy New Year, everyone. My new coffee mug for work does NOT mean that I’ll be working from home all year 🤪
0
1
11
RT @ZahraZahir10: A proud moment to celebrate this achievement as a PhD mom #WomenInSTEM. Massive thanks to my supervisors @ColetteBoskovi….
0
4
0
Pleased to have contributed to this work led by @Ritchiegp1 .
pubs.rsc.org
A reversible change in a material's fluorescence spectrum on the application of force is known as mechanofluorochromism (MFC) and is a well-established field of study. However, the mechanism(s)...
0
2
4