RCNS TheoChem Group (@rcnstheochem) 's Twitter Profile
RCNS TheoChem Group

@rcnstheochem

Computational chemistry group at Research Centre for Natural Sciences. Connecting the dots between experiments and computations. DFT | MD | Kinetics

ID: 1274005701258592261

linkhttp://www.ttk.hu/szki/en/theoretical-chemistry-research-group/ calendar_today19-06-2020 15:47:24

17 Tweet

266 Followers

352 Following

RCNS TheoChem Group (@rcnstheochem) 's Twitter Profile Photo

Happy to see that our study is featured as a supplementary cover in the latest issue of #OL. Delighted to work with Petri Pihko and Discontinued, and good job Csokas Daniel! doi.org/10.1021/acs.or…

Happy to see that our study is featured as a supplementary cover in the latest issue of #OL. Delighted to work with <a href="/PetriPihko/">Petri Pihko</a> and <a href="/juhesiit/">Discontinued</a>, and good job <a href="/danielcsokas/">Csokas Daniel</a>!

doi.org/10.1021/acs.or…
Lars Goerigk (@lgoer_compchem) 's Twitter Profile Photo

Remember our trip to the ground-state DFT zoo? The trip continues and takes you for free to the TD-DFT zoo. Besides some tips for non-experts, this is also the first comprehensive review of time-dependent double-hybrids #compchem Dr Marcos Casanova-Páez publish.csiro.au/CH/CH20093

RCNS TheoChem Group (@rcnstheochem) 's Twitter Profile Photo

Huge congrats to the team led by Erdélyi Máté at Uppsala University whose work on three-center, four-electron [D–X–D]+ bonding is featured in Chemistry World. 👏 Happy that we could contribute to this field!🖥️

todd martinez (@toddjmartinez) 's Twitter Profile Photo

Get ready to experience voice-controlled quantum chemistry! ChemVox performs real-time quantum chemistry calculations, returning results in seconds. You can use it on your mobile phone or Alexa capable devices: amzn.to/2Ds2G7s #chemtwitter #compchem OpenAcademics #Alexa

RCNS TheoChem Group (@rcnstheochem) 's Twitter Profile Photo

Pleased to share our latest article on FLP-catalyzed asymmetric hydrogenation of imines. Congrats to Andrea Hamza AND shout-out to HelsinkiCatLab for the experiments. Free access below.👇 pubs.acs.org/doi/10.1021/ac…

The Ashley Group (@the_ashleygroup) 's Twitter Profile Photo

Excited to share that the all-new iPr3SnNTf2 is more Lewis acidic than its iPr3SnOTf cousin, and opens up some interesting FLP hydrogenations of esters for the first time. Many thanks to the Pápai group for their fascinating mechanistic insights! pubs.acs.org/doi/10.1021/ac…

RCNS TheoChem Group (@rcnstheochem) 's Twitter Profile Photo

A milestone has been reached! H2020-funded Compbat project has a database comprising ca. 6700 pyridoxal-derived molecules for redox flow battery development. More👇 ttk.hu/en/recent-news…

Compbat (@compbat1) 's Twitter Profile Photo

#CompBat Steering Board Meeting Read the news about the semi-annual progress meeting on our website to discover more details regarding the progress made and future steps ⬇️ compbat.eu/2021/11/10/ste… #RCNS_HAS #DFT #flowbatteries #euproject

#CompBat Steering Board Meeting
Read the news about the semi-annual progress meeting on our website to discover more details regarding the progress made and future steps ⬇️
compbat.eu/2021/11/10/ste…

#RCNS_HAS #DFT #flowbatteries #euproject