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Physical Chemistry Chemical Physics : PCCP|May 22, 2026
Resolving the trifecta of discrepancies regarding the phosphorus suboxide P4OEthan J Poncelet, Alexander G Heide, Mitchell E Lahm, et al.Journal of Computational Chemistry|January 10, 2024
Exploring the Tl H potential energy surface: A comparative analysis with group 13 systems and experimentCarson L Tang, Alexander G Heide, Alexandra D Heide, et al.Journal of Chemical Theory and Computation|May 18, 2018
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid DevelopmentDaniel G A Smith, Lori A Burns, Dominic A Sirianni, et al.The Journal of Chemical Physics|December 2, 2021
Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programsDaniel G A Smith, Annabelle T Lolinco, Zachary L Glick, et al.Pageof 1