Ricardo Mata
@notherchemist
Theoretical Chemist at @uniGoettingen
ID: 1234591617601998848
02-03-2020 21:29:24
100 Tweet
327 Takipçi
145 Takip Edilen
We are #hiring... interested? Check out this opportunity to be part of Alcarazo Lab. #postdoc #ChemTwitter
Grundlage der zukünftigen Quantenchemie: Die DFG public | @[email protected] fördert unser Graduiertenkolleg BENCh RTG 🧪💻 für weitere 4,5 Jahre. Der Schwerpunkt liegt auf der Entwicklung neuer Experimente, welche etablierte theoretische Modelle herausfordern. uni-goettingen.de/de/3240.html?i…
Well done everyone BENCh RTG 🧪💻 on the successful extension of Research Training Group “Benchmark Experiments for Numerical Quantum Chemistry”. BENCh has an interdisciplinary approach combining experimental and theoretical methods: uni-goettingen.de/en/3240.html?i…. Thanks DFG public | @[email protected]
The Catalytic Mechanism of Acetoacetate Decarboxylase: A Detailed Study of Schiff Base Formation, Protonation States, and Their Impact on Catalysis #MolecularDynamics pubs.acs.org/doi/10.1021/ac… Ricardo Mata Vol63 Issue10 #JCIM #compchem
The HyDRA raises its many heads and many it were with more than 30 authors. We report results of a blind challenge on predicting water OH stretching frequency shifts in complexes with small organic molecules. BENCh RTG 🧪💻 Ricardo Mata pubs.rsc.org/en/content/art…
Starts tomorrow the Chemistry & Biology CrossTalks 2023. Looking forward an amazing day of science and fun between Pedro M. P. Gois, Ricardo Mata Alcarazo Lab, at the amazing Academia das Ciência de Lisboa Academia das Ciências de Lisboa sites.ff.ulisboa.pt/goislab/crosst…
Kicking off the CrossTalks2023 with Ricardo Mata Alcarazo Lab Pedro M. P. Gois at the Academia das Ciências de Lisboa
And the day closes with a great dinner at Rosa da Rua no Bairro Alto. Thank you Ricardo Mata Alcarazo Lab and Johannes Walker for joining us at the Academia das Ciências de Lisboa.
A simple algorithm to relax proton positions and avoid biases in multicomponent calculations. Let the protons roam. Ricardo Mata go.acs.org/92h
Chemical bonding characterization using APOST-3D: Official release of the code in The Journal of Chemical Physics, and runs in parallel!🥳🥳 Special thanks to Pedro Salvador for the opportunity, and all researchers involved in making it evolve. Soon more to come! pubs.aip.org/aip/jcp/articl…