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Maximilian Scheurer

5PUBLICATIONS

220CO-AUTHORS

Programming languagesTheoretical quantum chemistryThermodynamics and statistical physicsFormal methods for software

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Publications (5)

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|Dec 02, 2021

Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs.

Daniel G A Smith, Annabelle T Lolinco, Zachary L Glick

|Sep 02, 2021

Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package.

Evgeny Epifanovsky, Andrew T B Gilbert, Xintian Feng

|Aug 24, 2020

Complex excited state polarizabilities in the ADC/ISR framework.

Maximilian Scheurer, Thomas Fransson, Patrick Norman

|Jul 17, 2020

Recent developments in the PySCF program package.

Qiming Sun, Xing Zhang, Samragni Banerjee

|May 17, 2020

Psi4 1.4: Open-source software for high-throughput quantum chemistry.

Daniel G A Smith, Lori A Burns, Andrew C Simmonett

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Frequent Collaborators

3 joint publications

Andreas Dreuw

3 joint publications

Susi Lehtola

2 joint publications

Daniel G A Smith

2 joint publications

Lori A Burns

2 joint publications

Andrew C Simmonett

2 joint publications

Peter Kraus

2 joint publications

Holger Kruse

2 joint publications

Roberto Di Remigio

2 joint publications

Asem Alenaizan

2 joint publications

Jonathon P Misiewicz

Frequent Collaborators

3 joint publications

Andreas Dreuw

3 joint publications

Susi Lehtola

2 joint publications

Daniel G A Smith

2 joint publications

Lori A Burns

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