Christopher J. Stein

According to our database, Christopher J. Stein authored at least 4 papers between 2019 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2024

Spin parameter optimization for spin-polarized extended tight-binding methods.

Siyavash Moradi, Rebecca Tomann, Josie Hendrix, Martin Head-Gordon, Christopher J. Stein

J. Comput. Chem., December, 2024

2023

Supporting Information for the Journal Article "High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference treatment".

Jan P. Unsleber, Hongbin Liu, Leopold Talirz, Thomas Weymuth, Maximilian Mörchen, Adam Grofe, Dave Wecker, Christopher J. Stein, Ajay Panyala, Bo Peng, Karol Kowalski, Matthias Troyer, Markus Reiher

Dataset, January, 2023

2022

Supporting Information for the Journal Article "High-throughput ab initio reaction mechanism exploration in the cloud with automated multi-reference treatment".

Jan P. Unsleber, Hongbin Liu, Leopold Talirz, Thomas Weymuth, Maximilian Mörchen, Adam Grofe, Dave Wecker, Christopher J. Stein, Ajay Panyala, Bo Peng, Karol Kowalski, Matthias Troyer, Markus Reiher

Dataset, November, 2022

2019

autoCAS: A Program for Fully Automated Multiconfigurational Calculations.

Christopher J. Stein, Markus Reiher

J. Comput. Chem., 2019