
musichem lab
@musichemlab
Research group of Multiscale Simulations for #Chemistry and #MaterialsScience @uninaIT - PIs: @quantumpeacock & @anitachemwalker - Account run by group members
ID: 1509968648303267845
https://www.musichem.unina.it/ 01-04-2022 18:59:24
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Enjoyed this collaborative effort with @gagliardi8 Abhishek Mitra Ana B. Muñoz-GarcĂa Michele Pavone on oxygen evolution with Iridium Oxide catalysts using multireference methods doi.org/10.1021/acs.jp⊠Gagliardi Group musichem lab UChicago Chemistry Unina Federico II The Journal of Physical Chemistry

News musichem lab!!Francesca Francesca Fasulo has been promoted to Junior Assistant Professor (RTDa) at the Physics Dept! Dipartimento di Fisica "E. Pancini". Well deserved Francy, congratulations!! We are so lucky to have you in our group! â€ïž Michele Pavone Unina Federico II


Happy to share first paper by Francesco Sessa in our lab. New insights on molten carbonate electrolyte for MC fuel cells & electrolyzers, just out in PCCP Enjoy the reading! - Great collaboration with ENEA H2 team đ Michele Pavone Ana B. Muñoz-GarcĂa pubs.rsc.org/en/content/artâŠ

đ©đ»âđŹâïžWe are deeply grateful to our friends and colleagues that also this year made the MUSICHEM #springretreat a wonderful experience for us all, with great discussion on different topics inspired by the natural beauty of the Island of #Capri! đïž Ana B. Muñoz-GarcĂa Michele Pavone


musichem lab at the inauguration of the first Italian Superconducting Quantum Computer, result of the vision and leadership of prof. Francesco Tafuri Dipartimento di Fisica "E. Pancini", proud to be Unina Federico II!!


A new Dr. has born at musichem lab ! đšđœâđ Gennaro V. Sannino has obtained his PhD with a great public defense and we could not be more proud! Ad maiora, Gennaro ! đ€© Michele Pavone Ana B. Muñoz-GarcĂa


Happy to share the last paper from Gennaro PhD Gennaro V. Sannino, on the role of oxygen vacancy in tuning the SnO2 conduction band edge potential & an effective way to compute it! In collaboration with our friends at @Enea Portici Michele Pavone Ana B. Muñoz-GarcĂa doi.org/10.1002/jcc.27âŠ

This week, young musichemists are presenting their work in prestigious international & national conferences #reteitalianafotovoltaico #instm #ise #energystorage Way to go, you are doing awesome! Gennaro V. Sannino Adriana Pecoraro Francesca Fasulo Aniello Sara Balocco


Musichem Stevenson Lauren in Dublin! Arianna Massaro & Francesca Fasulo delivered 4 oral communications (two each) and enjoyed the wonderful Euchems community, the EYCN sessions for young chemists and the amazing program, with also two inspiring Nobel Prize Lectures!


Check out our last paper on layered oxide for Na-ion batteries and RTIL in chemistryofmaterials from a great collaboration with GAMELab@PoliTO and ENEA - Enjoy the read... itâs open access! DscUnina Arianna Massaro Michele Pavone Ana B. Muñoz-GarcĂa pubs.acs.org/doi/full/10.10âŠ

Great new collaborative work! Thank you so much musichem lab! Enjoy the reading, itâs open access

Big congrats to Francesca Fasulo! Being at your side all these years has been a great honor for me and Ana B. Muñoz-GarcĂa. We couldnât be happier the #CompChem Division of @SocChemIta recognized your outstanding achievements with this prize, absolutely deserved! #SuperFrancy #SCI2024


đ„Alert! the last Michael Garoutte đŒâŹ paper by Dr. TerĂĄn and Francesca Fasulo in collaboration with our friend in #biocrystallography (A. Merlinoâs lab) and #inorgchem (MatMoPol Santi Herrero) has just been selected as #HotArticle by Inorg Chem Frontiers- enjoy đ pubs.rsc.org/en/Content/ArtâŠ

Luigi Bonati Teresa Head-Gordon Lab UC Berkeley Michele Pavone musichem lab talks about embedded cluster techniques and their application in catalysis


Happy to share the stunning artwork by Dr. TerĂĄn for our paper on protein-bound paddlewheel Ru-complexes featured as the inside cover of the latest issue of Inorganic Chemistry Frontiers! doi.org/10.1039/D4QI01âŠ


New article out!đWe are honoured to contribute to special issue on The Journal of Physical Chemistry dedicated to @FrancescIllas & Gianfranco Pacchioni with our latest results on PEO structuring on TiO2 surface from MetaD simulations Arianna Massaro Francesca Fasulo Ana B. Muñoz-GarcĂa Michele Pavone pubs.acs.org/doi/10.1021/acâŠ

Our MSc student Manuel has been awarded the #PosterPrize at #MYCSConference organized by SCI Giovani for his Thesis Project on computational study of Prussian Blue analogues for energy storage devices. Congratulations!! đ DscUnina Arianna Massaro Ana B. Muñoz-GarcĂa Michele Pavone


Adriana (Adriana Pecoraro ) is representing the Musichem lab Materials Research Society (MRS) in Boston with 3 oral communications on our latest results on solar cells âïž


New Paper Alert!đ Atomistic insights into solid-state phase transitions in NIB cathodes unveiled in our latest work ACSEnergyLett pubs.acs.org/doi/10.1021/ac⊠Kudos to our brilliant Aniello đ & team Arianna Massaro Ana B. Muñoz-GarcĂa Michele Pavone #EnergyStorage #BatteryResearch #NIBs

Musichem goes bio!đ Happy to share last paper by brilliant duo Francesca Fasulo & Dr. TerĂĄn on QM(postHF)/MM modeling of oxygen transport in hemocyanin. Enjoy the reading! Itâs OA JCTC Papers HFSP Dipartimento di Fisica "E. Pancini" DscUnina Ana B. Muñoz-GarcĂa Michele Pavone pubs.acs.org/doi/10.1021/acâŠ