Miquel Huix-Rotllant
@HuixRotllant
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Quantum Chemist - @CNRS Researcher - Institut de Chimie Radicalaire - Aix-Marseille University
Marseille, France
Joined May 2021
You can follow the theory lectures of the @EuChemS School on Computational Chemical Biology through the #MoBioChem YouTube channel. Molecular Dynamics, Cheminformatics, Free-Energy Methods, Machine-Learning Potentials, Coarge-Grained Models, and QM/MM https://t.co/08R663aemF
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So happy to see our joint paper out in the world! Great working with @katheVillag and the whole team on this one 😊🙌
Check out our latest work just out in @ACSCatalysis! We show that EDOT-based conjugated trimers can drive gas-phase CO₂ reduction to ethane under visible light. With a fantastic team and collaborators! 🙌@ICIQchem @FundlaCaixa @MaserasGroup
https://t.co/SFoPcCAJy2
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📢📢Interested in transition metal complexes' photophysics? PhD opening at @LudoTroian 's lab (UCL, Louvain-la-Neuve) and at my lab (KU Leuven). Please RT
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New preprint available: "Assessing Spin-flip Time-Dependent Density-Functional Based Tight-Binding For Describing Photoisomerisation Reactions" | ChemRxiv - https://t.co/mcQsq1DKgC
#compchem
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Two PhD-positions in organic chemistry are available in my research group as a part of MSC-DN ‘Photo-switchable ultra-thin membranes for molecular separation’. Official recruitment will soon be open: https://t.co/JWDuOXE7k4
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A PhD position in theoretical chemistry (2025-2028) is available in my group starting in October. Info&Apply: https://t.co/lEZgVRn8F6
#academicjobs #compchem Please RT
huixrotllant.github.io
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Great to visit Nicolas Ferré and @HuixRotllant at the Institut de Chimie Radicalaire in Marseille for the PhD defense of Simone BONFRATE. #compchem
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Do you want to work at the interface of molecular simulations, structural biology experiments and #AI? Come to Paris for a PhD at @institutpasteur. 1 PhD position is available in our lab funded by @ERC_Research. Please repost!! #compchem #compbio Info 👇
research.pasteur.fr
One PhD thesis in the “Computational Structural Biology” lab headed by Dr. Max Bonomi is available for 3 years. The position is funded by the ERC Consolidator Grant 2022 “bAIes”. The unit is part […]
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#retweet Join our group Fall 2025! Projects: method development for drug design, ML, and MD simulations. Candidates with a strong coding background (specially in C++) are ideal! Apply through: https://t.co/gJCX8bEgZK Deadlines: Preferred: December 1st Final: December 15
chem.ufl.edu
The Department of Chemistry granted its first master’s degree in 1909 and the first Ph.D. in 1930. Since then, we have awarded over 2000 graduate degrees. The faculty are engaged in research in all...
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We have an open PhD position on the study of new photoswitches based on CN and CP bonds, as part of the MSCA-DN LUMIERE 💡 Still 10 days to apply! Please RT 📣 https://t.co/wwIjLPlZTa
uu.varbi.com
Letar du efter ett rekryteringssystem? Varbi Recruit det användarvänliga och heltäckande rekryteringsverktyget som effektiviserar ditt rekryteringsarbete. Besök oss för mer information!
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Thrilled to share our last work in collaboration with @YangXiong2022 just accepted in @angew_chem on Visible light‐mediated [4+2] annulation of silylimines with olefins involving Diradical Hydrogen Atom Transfer (DHAT) of C−H Bonds
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A new paper on a spectroscopic and theoretical study of the quantum-mechanical dynamics of voltage-sensitive fluorescent AR3 variants was published in Chem. Sci.!🥳🎉Energy barrier of retinal bond twisting is essential. https://t.co/Dwalg0vUGB
@ChemicalScience #OpenAccess
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We are excited to share that our new article has just been published in Acc. Chem. Res. Origin of the Difference in Proton Transport Direction between Inward and Outward Proton-Pumping Rhodopsins | Accounts of Chemical Research
pubs.acs.org
ConspectusActive transport is a vital and ubiquitous process in biological phenomena. Ion-pumping rhodopsins are light-driven active ion transporters that share a heptahelical transmembrane structu...
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🚀 OpenQP's main article is out! Next-gen quantum software featuring MRSF-TDDFT. Read: https://t.co/8sZGkzOH40 & https://t.co/NAJwwHDtwP. Get the code:
pubs.acs.org
The OpenQP (Open Quantum Platform) is a new open-source quantum chemistry library developed to tackle sustainability and interoperability challenges in the field of computational chemistry. OpenQP...
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🚨 Post-Doc Opening in Quantum Chemistry! 🚨 Join us at Kyungpook Nat'l Univ 🇰🇷 for research in MRSF-TDDFT & excited-state dynamics! 🔹 Apply: Send CV + refs to Prof. Cheol Ho Choi (cchoi@knu.ac.kr) 🔹 Research: https://t.co/QSHv4a6G9s 🔹 SW: https://t.co/TYOUSg63Sd
@ChChoi
github.com
The main repository of Open Quantum Platform (OpenQP) maintained by Choi Group at KNU. - Open-Quantum-Platform/openqp
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We are happy to present 🔥ℝ𝕖𝕘𝕖𝕟𝕖𝕣𝕒𝕥𝕚𝕧𝕖 ℙ𝕙𝕠𝕥𝕠𝕔𝕒𝕥𝕒𝕝𝕪𝕤𝕚𝕤💥 to the community... Try your most crazy reactions within this manifold 🫴 https://t.co/RAjTH9TJCf
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Advanced quantum and semiclassical methods for simulating photoinduced molecular dynamics and spectroscopy, with @elliealpacino @FarajiShirin
https://t.co/GnFrlqe0cy
wires.onlinelibrary.wiley.com
Controling molecular processes using light.
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Radical Polarity | Journal of the American Chemical Society @nagiblab @OhioState @TotalSyntheses #Radical #Polarity
pubs.acs.org
The polarity of a radical intermediate profoundly impacts its reactivity and selectivity. To quantify this influence and predict its effects, the electrophilicity/nucleophilicity of >500 radicals has...
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With @mj_janicki we showed for the 1st time that S...S chalcogen bonds can work as proxies for directional & selective electron transfer. This could find interesting applications in photoredox chemistry! See our work in @angew_chem
https://t.co/Oo8BpJpQbZ
@PWr_Wroclaw @NCN_PL
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MSc internship offer #atmoschem #compchem #PFAS
@PC2A_umr8522 @RechercheUlille @CNRS_HdF
@ED_SMRE @labexcappa @CperEcrin
@LatinXChem @CIC_ChemInst @SCF @RJ_SCF
@ASU
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