Henry F Schaefer Iii

125PUBLICATIONS

125CO-AUTHORS

Photonics, optoelectronics and optical communicationsTheoretical quantum chemistryFormal methods for softwareMetal cluster chemistryComputational chemistry

Get your video featured.

Publish with JoVE

Get your video featured.

Publish with JoVE

Publications (125)

Sort by Publication Date:

|May 22, 2026

Resolving the trifecta of discrepancies regarding the phosphorus suboxide P<sub>4</sub>O.

|Apr 13, 2026

Concordant Mode Approach (CMA): Vibrational Analysis of New and Upgraded Intermolecular Benchmarks for Noncovalent Bonding.

Laura N Olive Dornshuld, Mitchell E Lahm, Nathaniel L Kitzmiller

|Jan 10, 2026

Methods in PES-Learn: Direct-Fit Machine Learning of Born-Oppenheimer Potential Energy Surfaces.

Ian T Beck, Justin M Turney, Henry F Schaefer

|Jan 01, 2026

Toward the Observation of Dimagnesocene.

Connor G Briggs, Stephen M Goodlett, Henry F Schaefer

|Dec 26, 2025

Vibrational Signatures of Unrealized Phosphorus Suboxide Intermediates in White Phosphorus Oxidation Reactions.

Ethan J Poncelet, Mitchell E Lahm, Anna G Poncelet

|Nov 08, 2025

Hydrogen Bond Benchmark: Focal-Point Analysis and Assessment of DFT Functionals.

Erica C Mitchell, Lucas Azevedo Santos, Pascal Vermeeren

Pageof 21

Frequent Collaborators

26 joint publications

Justin M Turney

17 joint publications

Gregory H Robinson

12 joint publications

Yuzhong Wang

12 joint publications

Robert Bruce King

11 joint publications

Mitchell E Lahm

9 joint publications

Gary E Douberly

9 joint publications

Pingrong Wei

7 joint publications

Nathaniel L Kitzmiller

7 joint publications

Phuong M Tran

6 joint publications

Wesley D Allen

Frequent Collaborators

26 joint publications

Justin M Turney

17 joint publications

Gregory H Robinson

12 joint publications

Yuzhong Wang

12 joint publications

Robert Bruce King