AutschbachLab

Dr. Jochen Autschbach's computational chemistry research group at the University at Buffalo.

[Nature Communications @NatureComms]

New collection Alert!🔔It showcases @NatureComms recent publications on f-block elements, and covers fundamental science, materials and applications. Happy reading!😃▶️https://t.co/SmhE0CghHW
#felements #lanthanides #actinides #chemistry #materials #chemtwitter #OpenAccess

[AutschbachLab @AutschbachLab]

Congratulations to Herbert Ludowieg for his recent publication in @ScienceAdvances and for being the #UBChemistryHighlight for June! https://t.co/CjLYkrIoQX

[AutschbachLab @AutschbachLab]

Congratulations to Dr. Adam Philips and all other graduates of the #UBClassof2021 !

[AutschbachLab @AutschbachLab]

Our recent work on the puzzling two-peaked X-ray absorption structure in certain cerium complexes is now tagged as VIP-very important paper and featured on the front cover of Chemistry-A European Journal!
https://t.co/hvSj7LSsPX

[AutschbachLab @AutschbachLab]

Check out our new collaborative #research in @NatureComms!
https://t.co/0nEEn7psOL

[AutschbachLab @AutschbachLab]

New collaborative #research in @ChemicalScience https://t.co/YlNOyuGp6s

[AutschbachLab @AutschbachLab]

Check out our new #research in the Journal of Chemical Theory and Computation! https://t.co/j3gpXKHGdi
@AmerChemSociety @UBChemistry @UBScience @UBuffalo

[UBuffalo Science News @UBScience]

Surprise! At high pressures, curium can form unexpected covalent bonds. ⚛️ Study led by @TEAS_Actinides, #UBuffalo's Jochen Autschbach (@AutschbachLab) and Eva Zurek, and @RWTH. Published today in Nature: https://t.co/pdBH8tp6Nv Adventures in high-pressure #chemistry!

[AutschbachLab @AutschbachLab]

Read our latest #research, published with @SpringerNature in @Nature! @UBChemistry @UBScience @UBuffalo

https://t.co/bKD0frMCcL

[AutschbachLab @AutschbachLab]

Our new collaborative work is now online in Inorg. Chem.
@UBChemistry @UBScience @UBuffalo
https://t.co/vMwElmOog7

[AutschbachLab @AutschbachLab]

Long‐lived circularly‐polarized phosphorescence in helicene‐NHC‐rhenium(I) complexes: the influence of helicene, halogen and stereochemistry on emission properties https://t.co/ZEvUc1ELgb
@UBChemistry @UBScience @UBuffalo

[AutschbachLab @AutschbachLab]

The Sodium Anion Is Strongly Perturbed in the Condensed Phase Even Though It Appears Like a Free Ion in Nuclear Magnetic Resonance Experiments https://t.co/mM99hHBA1T
@UBChemistry @UBScience @UBuffalo

[AutschbachLab @AutschbachLab]

Ab Initio Analysis of Metal–Ligand Bonding in An(COT)2 with An=Th, U in Their Ground‐ and Core‐Excited States @UBChemistry @UBScience
@UBuffalo https://t.co/cEBj2zUebD

[AutschbachLab @AutschbachLab]

Proton NMR relaxation from molecular dynamics: intramolecular and intermolecular contributions in water and acetonitrile @UBChemistry @UBScience @UBuffalo https://t.co/qge8ieGfdB

[AutschbachLab @AutschbachLab]

https://t.co/u8wgQ74fXH

[AutschbachLab @AutschbachLab]

Use of 15N NMR Spectroscopy to Probe Covalency in a Thorium Nitride
Published in Chemical Science! @UBChemistry @UBScience @UBuffalo
https://t.co/tXZm41uj5q

[AutschbachLab @AutschbachLab]

Some great theoretical-experimental collaborative work coming from Dr. Claudiu Sergentu! @UBChemistry @UBScience @UBuffalo https://t.co/v0VWs3f2Lz

[AutschbachLab @AutschbachLab]

https://t.co/hqVjeZsx7c

[AutschbachLab @AutschbachLab]

https://t.co/yXNQir0JE1

[AutschbachLab @AutschbachLab]

Congratulations to Claudiu Sergentu for his first-author paper just accepted in Chemical Science!
https://t.co/RAbdl9hBOY