Henry F. Schaefer Iii
0000-0003-0252-2083
10 papers found
Refreshing results…
Cumulants as the variables of density cumulant theory: A path to Hermitian triples
Four isomers of In 2 H 2 : a careful comparison between theory and experiment
Assessing the orbital-optimized unitary Ansatz for density cumulant theory
Reduced Density Matrix Cumulants: The Combinatorics of Size-Consistency and Generalized Normal Ordering
Psi4 1.4: Open-source software for high-throughput quantum chemistry
Sulfurous and sulfonic acids: Predicting the infrared spectrum and setting the surface straight
Re-examining ammonia addition to the Criegee intermediate: converging to chemical accuracy
The non-covalently bound SO⋯H2O system, including an interpretation of the differences between SO⋯H2O and O2⋯H2O
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
Missing publications? Search for publications with a matching author name.