Daniel Reta
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danireta.bsky.social
Daniel Reta
@danireta.bsky.social
Ikerbasque Reseach Associate Professor at UPV/EHU & DIPC, Donostia, Spain

Physical Chemist working on Molecular Magnetism & Organic Radicals using Computational Chemistry and Spectroscopy 🧲 🖥 🧪

Website: danielreta.com
Reposted by Daniel Reta
Whether you're starting out in a theory project on molecular magnetism, or a synthetic chemist curious about how the magic happens, check out my new tutorial review: pubs.rsc.org/en/content/a... @rsc.org @scienceanu.bsky.social @uomresearchit.bsky.social
Ab initio electronic structure calculations of lanthanide single-molecule magnets; a practical guide
Research into single-molecule magnetism lies at the nexus of challenging synthetic chemistry, spin physics and ab initio quantum chemistry. There are no “one-size-fits-all” textbooks and as such it ca...
pubs.rsc.org
November 11, 2025 at 12:34 PM
Reposted by Daniel Reta
We are hiring PhD students in very different research areas! Please see two adverts below, and note that the second position is restricted to UK students only. Please re-post; interested candidates please contact me by email:
www.findaphd.com/phds/project...

www.findaphd.com/phds/project...
[FSE Bicentenary PhD] Controlling magnetic relaxation times in rare earth single-molecule magnets and qubits at The University of Manchester on FindAPhD.com
PhD Project - [FSE Bicentenary PhD] Controlling magnetic relaxation times in rare earth single-molecule magnets and qubits at The University of Manchester, listed on FindAPhD.com
www.findaphd.com
November 10, 2025 at 9:21 AM
Check out some of the amazing Science being done in Donostia!

dipc.ehu.eus/en/whats-new...
Visit the Quantum Mile: a journey through quantum physics research in Donostia
dipc.ehu.eus
October 23, 2025 at 9:39 AM
As part of outreach activities derived from the opening of the new Quantum Computer in Donostia, here is a cool virtual tour by the "Quantum Mile", featuring our lab!!
Check it out in Faculty of Chemistry -> Molecular Magnetism
millacuantica.smartmap.emovere.eu
Milla Cuántica
Recorrido Virtual Milla Cuántica
millacuantica.smartmap.emovere.eu
October 14, 2025 at 5:58 PM
Today I attended the opening of the new #IBM Quantum System 2 in Donostia, sitting merely a hundred meters from our lab.
Amazing commitment to science from the Basque government and research institutes here at the Basque Country. Proud to belong to this network
#Ikerbasque
@dipcehu.bsky.social
October 14, 2025 at 5:40 PM
Reposted by Daniel Reta
We are looking for postdoctoral candidates in the areas of organic electronics, operando spectroscopy in catalysis, advanced EPR. CV and cover letter to slageren@ipc.uni-stuttgart.de, stating what complementary expertise you bring and why our group interests you.
September 26, 2025 at 3:11 PM
Slightly disappointed after a week measuring cw ENDOR with not much to show for it. Still, it was great working with Vincent Maurel and getting to visit Grenoble. Hopefully more to come. #epr
September 26, 2025 at 2:29 PM
Reposted by Daniel Reta
📣 @xabierjota.bsky.social and I are looking for candidates for a fully funded PhD position at UPV / EHU to study intrinsically disordered proteins using molecular simulations and computational chemistry calculations
👩‍🔬🧑‍🔬

📅 Deadline: October 1st

👇 Details below, please RT
September 9, 2025 at 4:42 PM
Very proud of Javi, who presented his work as a summer intern at the @dipcehu.bsky.social, on nitroaromatics radical formation and their use to unlock novel chemical transformations. More to come soon!
#chemsky #organicradicals #epr
August 1, 2025 at 2:23 PM
Reposted by Daniel Reta
We are glad to announce that DIPC Activity Report 2024 is now available for download. Its pages summarize our vision and commitment with excellence science as a basis for long-term social and economic progress

tinyurl.com/5e4k9bxa
DIPC Activity Report 2024 is available online
We are glad to announce that DIPC Activity Report 2024 is now available for download. Its pages summarize our vision and commitment with excellence science as a basis for long-term social and economic...
tinyurl.com
July 2, 2025 at 7:14 AM
Presenting our work on the generation of nitroaromatic radicals and their novel reactivity at @rseq.bsky.social
#chemsky #compchem #epr
July 1, 2025 at 10:03 AM
Reposted by Daniel Reta
Delighted to announce the publication of our work in @nature.com, in collaboration with @nfchilton.bsky.social's group, on a dysprosium compound with magnetic memory at 100 Kelvin. Congrats to all authors inc. @gemmagransbury.bsky.social, @jeffjefftyjeff.bsky.social
www.nature.com/articles/s41...
Soft magnetic hysteresis in a dysprosium amide–alkene complex up to 100 kelvin - Nature
A dysprosium amide–alkene complex shows soft magnetic hysteresis loops up to 100 kelvin, arising from the high charge density of the amide ligands and the structural role of the pendant alkene.
www.nature.com
June 25, 2025 at 5:56 PM
Reposted by Daniel Reta
Bihar, ez ezazu galdu Jesus Ugaldearen hitzaldia

2025 ekainak 10 • 19:00
Ernest Lluch K.E. Donostia-San Sebastián

@dipcehu.bsky.social

www.donostiakultura.eus/eu/agenda/id...
Ideien kimika. Unibertso kimikoaren azken muga
Kimika Fakultatearen 50. urteurrena dela eta, 50 urte kimika zabaltzen zikloa antolatu da, bertan Kimika Fakultateko kideek Fakultatean garatzen diren hainbat gairen inguruan arituko dira, publiko oro
www.donostiakultura.eus
June 9, 2025 at 6:21 PM
Our first paper from the #RadicalProtON @erc.europa.eu project is out!
Turns out nitrobenzene is easily reduced by a host of anionic organo bases, unlocking nitroaromatics as potential radicals and yielding valuable radical bases in the process.
#epr #compchem #chemsky
pubs.acs.org/doi/10.1021/...
Radical Formation by Direct Single Electron Transfer between Nitrobenzene and Anionic Organo Bases
The presence of unpaired electrons, i.e., radicals, equips organic molecules with unique magnetic and reactivity properties. However, due to the reactive nature of radicals and the nontrivial chemistry required for their preparation, strict structural and electronic limitations are imposed on the available systems, limiting their potential applications. Thus, developing mechanisms that enable facile radical formation in simple reaction conditions, employing available and inexpensive reactants and applicable to general types of molecules, holds the key to capitalize on the extraordinary properties that radicals have to offer. Here, combining electron paramagnetic resonance spectroscopy and ab initio calculations, we uncover an unprecedented single electron transfer from multiple anionic organic bases (B–X+) to nitrobenzene [1], leading to the formation of stable nitrobenzenide radical ion-pair [1•–][X+] (X = Li, Na, K) and transient oxidized, radical bases B•. Our results establish nitroarenes as versatile radical precursors, providing a broadly applicable protocol for generating heteroatom-centered radicals and enabling radical transformations under mild conditions from inexpensive and readily available starting materials. Finally, we propose the [1]–[B–X+] couple as an unexplored platform with the potential to advance the field of frustrated radical pairs.
pubs.acs.org
June 6, 2025 at 7:50 AM
Reposted by Daniel Reta
Check out our latest group paper in collaboration with @danireta.bsky.social, now out in @commschem.nature.com. A lot of hard work to put this together, a great collaborative effort! #chemsky www.nature.com/articles/s42...
Synthesis, characterization and reactivity of a series of alkaline earth and rare earth iminophosphoranomethanide complexes - Communications Chemistry
Iminophosphoranomethanide ligands have been used to stabilize metal complexes, but their application as alkyl precursors in deprotonation reactions remains unexplored. Here, the authors prepare and ch...
www.nature.com
June 5, 2025 at 7:24 PM
Reposted by Daniel Reta
Zorionak Kimika Fakultateari 50 urteko ibilbide bikainagatik!!! 🎂🎂🎂🎂

tinyurl.com/22dm3p59

@upvehu.bsky.social
May 30, 2025 at 7:20 AM
I just got a paper accepted in a @acs.org journal as part of my @erc.europa.eu Starting Grant. My University @upvehu.bsky.social has an agreement with ACS, so I do not have to pay for the APCs. Turns out that ACS refuse to validate the agreement and won't publish my work. Great #OpenAccess policy
May 21, 2025 at 11:27 AM
Reposted by Daniel Reta
The ATRAE program from @ageinves.bsky.social aims "to facilitate the incorporation of consolidated research talent, of recognised international prestige"

Given the circumstances, this may be of particular interest for academics from the US

www.aei.gob.es/en/news/agen...
www.aei.gob.es
April 25, 2025 at 9:53 AM
Very happy to have presented our recent pre-print on nitrobenzene radical ion pair formation at the French EPR Society held in @iecb.bsky.social

Thank you @fichoulab.bsky.social for the opportunity!

chemrxiv.org/engage/chemr...
Radical Formation by Direct Single Electron Transfer between Nitrobenzene and Anionic Organo Bases
The presence of unpaired electrons in organic molecules, i.e., radicals, offers transformative magnetic and reactivity properties. However, due to the very nature of these radicals, strict electronic ...
chemrxiv.org
March 18, 2025 at 6:56 PM
Still one week to apply to one the 2 #PhD available in my group, in San Sebastián, Spain.

#chemsky
#compchem
#organicradicals
#molecularmagnetism

Come join us!

See below for more information.
📢📢

Two PhD positions and one summer internship available in our group to work within the ERC Starting Grant RadicalProtON project. Located at the Faculty of Chemistry of the University of the Basque Country, Spain.

More details on each position and how to apply below 👇
March 15, 2025 at 10:17 AM
Muy agradecido por haber participado en el ciclo de charlas organizado por la Facultad de Química de la @upvehu.bsky.social con motivo de su 50 aniversario, en @donostiakultura.bsky.social

#chemsky

www.donostiakultura.eus/es/agenda/to...
¿Todo eso con electrones?
Con motivo del 50 Aniversario de la Facultad de la Química, se ha preparado el ciclo de conferencias 50 años difundiendo la Química. En este ciclo los miembros de la Facultad hablarán sobre d
www.donostiakultura.eus
March 12, 2025 at 8:07 AM
Thrilled to have @nfchilton.bsky.social visiting us next week and hear what's new from his group!
We'll treat you to some nice pintxos and txakoli 🥳

#compchem

dipc.ehu.eus/en/scientifi...
Spin dynamics and coupling in the f-block
dipc.ehu.eus
February 28, 2025 at 7:29 AM
Reposted by Daniel Reta
It's not just the Mediterranean Sea.

I wish people would wake up.

"This is a time – as the world focuses on cultural and shooting wars – to gain the scientific understanding needed to address climate change, if and when the world comes to its senses"
James Hansen
February 26, 2025 at 9:22 AM