Tim Schramm

23 posts

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Tim Schramm

Tim Schramm

@tkschramm

Graduate Researcher in Computational Chemistry @GrimmeLab | M. Sc. @RWTH and with @mhg_group

Bonn Katılım Temmuz 2015
118 Takip Edilen52 Takipçiler
Tim Schramm retweetledi
Corin Wagen
Corin Wagen@CorinWagen·
The long-anticipated g-xTB paper was just released on ChemRxiv. g-xTB is the next semiempirical method from Grimme and co-workers at @UniBonn. (I've heard rumors about this work for almost two years.) Here's some quick thoughts upon an initial read:
Corin Wagen tweet media
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Xiao Liu 刘虓
Xiao Liu 刘虓@XiaoLiu161147·
(1/n) Excited to share my work with @mhg_group & W. H. Green group @ MIT “Revisiting a large and diverse data set for barrier heights and reaction energies: best practices in density functional theory calculations for chemical kinetics” published in @PCCP! pubs.rsc.org/en/content/art…
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Tim Schramm
Tim Schramm@tkschramm·
Just in time for 2025: Our new @J_A_C_S paper, introducing "regioisomeric engineering" for stabilizing multi-electron organic flow batteries via charge and spin density redistribution as tracked by DFT! #compchem Read more: doi.org/10.1021/jacs.4…
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Bannwarth Lab
Bannwarth Lab@BannwarthTC·
Checkout MolBar, a new molecular identifier capable of describing non-central stereoisomerism like axial chirality and metal complex diastereomers. doi.org/10.26434/chemr…
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James Shee
James Shee@james_shee·
Nice to see our collaborative work designing new redox flow battery anolytes with @Toste_Group et al published in @J_A_C_S!
J. Am. Chem. Soc.@J_A_C_S

Indolo[2,3-b]quinoxaline as a Low Reduction Potential and High Stability Anolyte Scaffold for Nonaqueous Redox Flow Batteries | Journal of the American Chemical Society @Toste_Group @UCB_Chemistry @UCBerkeley @BerkeleyLab @JCESRHub @UMich @MichiganChem pubs.acs.org/doi/10.1021/ja…

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Tim Schramm
Tim Schramm@tkschramm·
Looking forward to seeing Isomnium again in Aachen and Cologne😁 This time with the *newly formed* German metal crew @JosieHendrix18, missing the American Vikings, though😭🤘🏼
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Xiao Liu 刘虓@XiaoLiu161147

Deliberately wore my Insomnium band shirt for the new group pic, as a memento from the concert I attended with former group members, @tkschramm, @JosieHendrix18, and @james_shee. It's saddening that they're no longer with us, but I'll still carry on @mhg_group's metalhead spirit!

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Tim Schramm retweetledi
nature
nature@Nature·
Fifty years of research shows that abortion access is crucial for health care and important for equality go.nature.com/3zWMK82
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Q-Chem
Q-Chem@QChemSoftware·
Z Wong, T Schramm, M Loipersberger, M Head-Gordon, F Toste "Revisiting the Bonding Model for Gold(I) Species: The Importance of Pauli Repulsion Revealed in a Gold(I)-Cyclobutadiene Complex" DOI: doi.org/10.1002/anie.2… More on feature ALMO-EDA (q-chem.com/explore/molecu…) #compchem
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Bundeskanzler a.D. Olaf Scholz
Bundeskanzler a.D. Olaf Scholz@KanzlerScholz·
Putin’s war must not be permitted to reopen old wounds. Reconciliation between Germany and Russia is an important chapter of history. We stand with #Ukraine. And with the Russians who are courageously standing up for peace, freedom and human rights.
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Keşfet

@UniBonn @RutgersU @demyanpro @mhg_group @PCCP @J_A_C_S @james_shee @Toste_Group