〈 Isaac | F. | Leach 〉
@if_leach
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🏳️🌈 PostDoc in @BistoniGroup @UniPerugiaNews, applying comp chem to develop organic battery tech & much more he/him 🇬🇧. Views=mine.
Perugia, Italy
Joined March 2022
Defended my PhD thesis @univgroningen🎉😁Thanks so much to everyone who supported me along the way and came out for it + a special thanks to @Liliana_CFlores and Lizzy Leach who did an amazing job organizing everything and guiding me through the ceremony💜Thesis link👇
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Very happy to share the first paper from my postdoc @BistoniGroup @UniperugiaNews
A Generally Applicable Method for Disentangling the Effect of Individual Noncovalent Interactions on the Binding Energy (Giovanni Bistoni and co-workers) @ahmetaltunfatih @if_leach @bistonigroup @UniperugiaNews #openaccess 🔓
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research.rug.nl
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Great read for those interested in #bioinorganic chem😀
Discussing the Terms Biomimetic and Bioinspired within Bioinorganic Chemistry | Inorganic Chemistry https://t.co/svTJ2xrnrp Engbers, van Langevelde, and co-workers 🔭⭐️Viewpoint ⭐️ @InorgChem #biomimetic #bioinspired #bioinorganic #structure #function #case_studies #meow #miaow
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Fantastic to be a part of a 🇺🇸🇳🇴🇿🇦 collaborative project: Gold Tripyrrindione: Redox Chemistry and Reactivity with Dichloromethane | Inorganic Chemistry
pubs.acs.org
The identification of ligands that stabilize Au(III) centers has led to the isolation of complexes for applications in catalysis, gold-based therapeutics, and functional materials. Herein, we report...
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Check out the recent @ScienceMagazine article on network control and emergence in stereoediting reactions in with contributions from FACCTs, the lab of @AlisonWendlandt, the @BistoniGroup, and Eugene Kwan! #ORCAqc #compchem
https://t.co/EwBULzEhbX
science.org
Stereochemical editing strategies have recently enabled the transformation of readily accessible substrates into rare and valuable products. Typically, site selectivity is achieved by minimizing...
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See this chapter for a more general overview of EOS analysis https://t.co/MopphqKYPN
onlinelibrary.wiley.com
Are quantum chemistry methods up to the challenge of matching with the definition of oxidation state (OS)? The term has been revised by the IUPAC, providing a more general and unambiguous definition...
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Really cool work on finding chemical concepts in quantum mechanics wavefunctions within the Effective Oxidation State framework. Great read! 🤗
I am thrilled to share that our work on Quantification of the Donor‐Acceptor Character of Ligands has been published @pesalse
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*** The cobalt-phosphine complex was synthesized and experiementally characterized by the group of B. Hunter while based at the Rowland Institue @Harvard University in Cambridge, Massachusetts, US (not the group of C. Hunter at @Cambridge_Uni in Cambridge, UK). My mistake😅
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1st paper as (co)corresponding author online!😁 We model many different TM complexes but it all started with this cool series of cobalt complexes from the Hunter group @Cambridge_Uni
@ACSCentSci @lab_klein
https://t.co/ivZt71Sr4W
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Excited for this! 😁
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1st day on the new job at the University of Perugia in Italy😀😎 I'm working in the Bistoni Group, focusing on applying comp chem to develop new materials for organic batteries (although I'm open to collabs on other projects 😉). Updates to follow... @UniPerugiaNews #PostDoc
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Local Energy Decomposition (LED) is a powerful tool within ORCA (@faccts_orca) to analyze non-covalent interactions. Check out the recent article by Bistoni, Neese, and co-workers on LED approaches for the quantification of London dispersion. #ORCAqc
https://t.co/lzMYl89key
pubs.acs.org
ConspectusLondon dispersion (LD) forces are ubiquitous in chemistry, playing a pivotal role in a wide range of chemical processes. For example, they influence the structure of molecular crystals, the...
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Great 6 points here, I couldn't agree more :)
The most important lessons I learned from doing a PhD. Thread 🧵
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Thanks! @EurJIC @ChemEurope @Wiley_Chemistry, this was a lovely email to open😄 Glad to see our work being read in your journal :)) https://t.co/Wrf7kkJBQb
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Happy to share another work coming out of @lab_klein 💃 Big ups to Dr. Kristo Hess ! 💪😁
Valence Tautomerism Induced Proton Coupled Electron Transfer:X-H Bond Oxidation with a Dinuclear Au(II) Hydroxide Complex (Johannes E. M. N. Klein and co-workers) #openaccess
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@ThomasFreese3 @FeringaLab @StratinghInst @ZernikeInst @univgroningen @LEAFinLabs More info in this video from Green Labs FSE / @ThomasFreese3, featuring @FeringaLab. @ScienceLinX @greenlabs_NL @GreenOfficeRUG @univgroningen
https://t.co/pdgEu34PMe
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