Robin Feldmann (@RobinFeldmann95) profile picture

Robin Feldmann

@RobinFeldmann95

PostDoc in theoretical chemistry @ETH

 Zurich, Switzerland
Joined September 2020
  • Tweets16
  • Following105
  • Followers115
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Robin Feldmann retweeted
Jan Unsleber (@Nabbelbabbel) profile picture
Jan Unsleber@Nabbelbabbel11 Oct 2022
Automated CAS selection for DMRG? Open-source and free? Yes please! AutoCAS v2.0.0 has had its Python release a few days ago. Well done @Max_Moerchen. Find it on PyPI and at github.com/qcscine/autocas #compchem cc: @QCstein
GitHub - qcscine/autocas

GitHub - qcscine/autocas

Contribute to qcscine/autocas development by creating an account on GitHub.

github.com
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Robin Feldmann retweeted
CompChemNews (@CompChemNews) profile picture
CompChemNews@CompChemNews14 Jun 2022
[JCTC] [ASAP] Explicitly Correlated Electronic Structure Calculations with Transcorrelated Matrix Product Operators dlvr.it/SSBqP2
Explicitly Correlated Electronic Structure Calculations with Transcorrelated Matrix Product...

Explicitly Correlated Electronic Structure Calculations with Transcorrelated Matrix Product...

Abstract. In this work, we present the first implementation of the transcorrelated electronic Hamiltonian in an optimization procedure for matrix product s

pubs.acs.org
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"Man ist es nicht gewohnt auf Probleme zu reagieren, die viele Jahre dauern...daher bin ich dankbar, dass jetzt die Jugend überall auf das Problem aufmerksam macht". #Physik-Nobelpreisträger Klaus Hasselmann @MPI_Meteo über das Engagement #FridaysforFuture gegen den #Klimawandel
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Robin Feldmann retweeted
JCTC Papers (@jctc_papers) profile picture
JCTC Papers@jctc_papers27 May 2021
[ASAP] Electron Dynamics with the Time-Dependent Density Matrix Renormalization Group ift.tt/3ftoGPC
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Robin Feldmann retweeted
Max Mörchen (@Max_Moerchen) profile picture
Max Mörchen@Max_Moerchen13 Oct 2020
Happy to share our new preprint on Tailored Coupled Cluster in different Correlation Regimes. arxiv.org/abs/2010.04841 #compchem #MarkusReiher
Tailored Coupled Cluster Theory in Varying Correlation Regimes

Tailored Coupled Cluster Theory in Varying Correlation Regimes

The tailored coupled cluster (TCC) approach is a promising ansatz that preserves the simplicity of single-reference coupled cluster theory, while incorporating a multi-reference wave function...

arxiv.org
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