@MaserasGroup

Computational Homogeneous Catalysis group at @ICIQchem Visit our official webpage: https://xitter.cf/t.co/IaI0KUZMYW Student-run twitter account #compchem #Ed_Ssan

 ICIQ, Tarragona
bit.ly/35IuBJz
Joined October 2019
  • Tweets413
  • Following303
  • Followers875
67Media
Do you know what are we doing? "It sounds like MAGIC, but it's not . . IT'S SCIENCE!!" #compchem #mazinchemz 👇👇👇👇👇 youtu.be/qNKN1RIJtJk
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Albert Solé-Daura@asoledauraOct 13
Happy to share EASIQ-Marcus, a code that automates Marcus-theory calculations for SET and EnT processes with Gaussian. Check it out 👇👇👇 Paper: onlinelibrary.wiley.com/doi/… Code: github.com/maserasgroup-repo… @ICIQchem @QCG_URV #compchem #marcustheory

EASIQ‐Marcus: An Automated Workflow for Applying Marcus Theory to Computational Chemistry Output...

Single electron transfer is a fundamental step in many chemically relevant transformations that remains understudied by calculation. EASIQ-Marcus, a Python-based code that transforms the output of...

onlinelibrary.wiley.com
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🤔🤔🤔Are you interested in learning how we handle single-electron transfer (SET) and energy transfer (EnT) in computational chemistry? Check out our new publication. 📝 doi-org.sabidi.urv.cat/10.10… @MaserasGroup @asoledaura @ICIQchem #Compchm #Marcustheory #EnT #SET
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What happens when a ketone reacts with α-monohaloborylsilylmethane—Peterson olefination or Boron–Wittig? 🤔 Check out our latest collaboration with the group of Fernández from #URV to discover the answer. 🔬📖 @MaserasGroup @ICIQchem #Compchem doi.org/10.1002/ceur.2025002…

Pivotal Synthesis of Tetrasubstituted Epoxides from Ketones and α‐Halo B/Si Ylides with Understan...

The preparation of diastereoselective 1,1,2,2-tetrasubstituted borosilylepoxides is described, involving the epoxidation of ketones with α-monohalo borylsilylmethane reagents. The nature of the...

chemistry-europe.onlinelibrary.wiley.com
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Today, we bid farewell to our dear group members @mdiazru and #Elise on their last day with us. Wishing you both a bright and successful future ahead. #compchem @MaserasGroup @ICIQchem
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Happy to see our new paper published in @J_A_C_S! Thanks to @MarcosGSuero, @MaserasGroup and coauthors @ICIQchem for the great collaboration.
J. Am. Chem. Soc.@J_A_C_S10 Jul 2025
Rh-Catalyzed Atroposelective Single-Carbon Insertion | Journal of the American Chemical Society @MarcosGSuero @ICIQchem pubs.acs.org/doi/10.1021/jac…

Rh-Catalyzed Atroposelective Single-Carbon Insertion

Abstract. Single-carbon insertion processes have gained considerable momentum over the past few years. Although innovative methods have emerged for convert

pubs.acs.org
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Maseras Group retweeted
ioChem-BD@ioChem_BD23 Jun 2025
The #ioChem-BD team is at #WATOC2025! Come meet us to learn more about our tools for sharing and exploring computational chemistry data. Let’s connect and collaborate! 🔬💻🌍
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Maseras Group retweeted
ioChem-BD@ioChem_BD16 May 2025
Shoutout to our users in @UniOslo! We will have a stall at WATOC 2025 #Oslo, by the way, come meet us in person!
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🚨 Don’t miss this opportunity to join our team at @ICIQchem to pursue a PhD! 💻 Project: Computational study of material-supported homogeneous complexes for CO₂ reduction 🔗 Apply now: careers.iciq.org/jobs/596816… 🗂️PhD 2025-11 FM 🗓️ Deadline: June 29, 2025
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Marina Díaz Ruiz@mdiazru24 Apr 2025
The latest work of my PhD is finally out in Chemistry Europe! Don't miss this comprehensive computational characterization of an organic electrosynthetic reaction enabled by overcharge protection. #compchem @MaserasGroup @ICIQchem chemistry-europe.onlinelibra…

Computational Organic Electrosynthesis: The Role of Overcharge Protectors

A computational investigation involving density functional theory-computed energies and microkinetic modeling leads to the full characterization of the mechanism of an organic electrosynthesis...

chemistry-europe.onlinelibrary.wiley.com
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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 pubs.acs.org/doi/10.1021/acs…
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ICIQ@ICIQchem7 Mar 2025
#ICIQNews 🔺Prof. @Carles_Bo's group has made a major step forward in predicting how polyoxometalates (#POM) form. ☄️This innovation removes previous limitations and represents a key milestone in inorganic chemistry. Read more 🔗iciq.org/new/a-smarter-way-t… @digital_rsc
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ICIQ@ICIQchem7 Mar 2025
#ICIQPhD 🎓Moltes felicitats, Dra. Díaz Ruiz from Prof. @MaserasGroup 📚Today @mdiazru has successfully defended her thesis on bridging the gap between homogeneous catalysis and organic electrosynthesis Learn more about her 🔗iciq.org/new/moltes-felicita…
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ICIQ@ICIQchem6 Mar 2025
#ICIQPhD 📚Thesis defense by @mdiazru from Prof. @MaserasGroup ➡️"Bridging the Gap Between Homogeneous Catalysis and Organic Electrosynthesis" 📅07/03/2025 🕘11:00 h 📍ICIQ Library Info 🔗iciq.org/event/bridging-the-…
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ICIQ@ICIQchem11 Feb 2025
#ICIQNews 👭 Celebrating #11F International Day of Women & Girls in Science 🟣From #científiques to #ICIQWomeninScience, we celebrate their contributions every day. The future of science is female too! Read more🔗 iciq.org/new/iciq-celebrates… @iCERCA @_BIST #WomenInSTEM
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🚨 Master Fellowship Opportunity! 🚨 Passionate about organometallic chemistry & catalysis? Join our research group at @ICIQchem as a Master’s student through the ICIQ Master Projects Fellowship Programme 2025! 😎 See below for further details. Deadline: March 16, 2025.
ICIQ@ICIQchem10 Feb 2025
#ICIQJobs 🗣️Join Master Projects Fellowship Programme ➡️3 grants available to work with Profs. @Perez_Temprano, @Carles_Bo & @MarcosGSuero. Apply now 🔗 careers.iciq.org/jobs/552911… #Fellowships #ScienceCareers @scq_iec @RSEQUIMICA @IntlStudentsHub @iCERCA @_BIST @SOMM_alliance
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Our PhD students, @mdiazru and @ed_ssan, had the pleasure of presenting their work at the 2nd meeting on inorganic and organometallic chemistry @rqio_scq @scq_iec. @ICIQchem #compchem
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rqio_scq@rqio_scq6 Feb 2025
Estem molt contents per l'acogida i l'alta participació en aquesta segona reunió 2RQIO-@scq_iec celebrada a la @universitatURV. Gràcies a tots els participants!
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📢 Applications open to join the second edition of the CAMLC workshop, a great opportunity for chemists who want to learn about cheminformatics, automation, and machine learning. September 16-19 in Zaragoza, Spain. 🗓️ Application deadline: February 28 👉🏻 camlcworkshop.github.io/
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Maseras Group retweeted
ICIQ@ICIQchem9 Jan 2025
#ICIQNews 👏Congrats to Prof. Feliu Maseras (@MaserasGroup), on receiving the Miguel Catalán – Paul Sabatier Award 2024 from the Société Chimique de France @reseauSCF Read more🔗iciq.org/new/prof-feliu-mase… @RSEQUIMICA @iCERCA
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ICIQ@ICIQchem17 Dec 2024
#ICIQJobs ➡️Would you like to be part of international community at one of the leading research institutes in #chemistry? 🔹#Postdoc at @HartreeFoca Group 🔹#Postdoc at @MaserasGroup 🔹#Postdoc at @MarcosGSuero Group ...& more! Explore🔗careers.iciq.org/ @iCERCA @_BIST
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