David H Bross

17PUBLICATIONS

32CO-AUTHORS

Catalysis and mechanisms of reactionsTheoretical quantum chemistryLasers and quantum electronicsChemical and thermal processes in energy and combustionAtmospheric aerosols

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Publications (17)

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|May 20, 2026

Mechanism, Thermochemistry, and Kinetics for the CH + N2 Reaction Leading to Prompt NO Formation in Combustion.

|Jan 26, 2026

Reducing the Cost of CCSD Basis Set Extrapolation in Ab Initio Computational Thermochemistry.

James H Thorpe, Peter R Franke, John F Stanton

|Apr 04, 2025

Discrepancies between Theory and Experiment in Determining the Ionization Energy of NF3.

Megan R Bentley, Peter R Franke, Kaila E Weflen

|Nov 29, 2024

Unifying thermochemistry concepts in computational heterogeneous catalysis.

Bjarne Kreitz, Gabriel S Gusmão, Dingqi Nai

|Sep 20, 2024

Accurate and reliable thermochemistry by data analysis of complex thermochemical networks using Active Thermochemical Tables: the case of glycine thermochemistry.

Branko Ruscic, David H Bross

|Jun 10, 2024

Importance sampling within configuration space integration for adsorbate thermophysical properties: a case study for CH3/Ni(111).

Katrín Blöndal, Kirk Badger, Khachik Sargsyan

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Frequent Collaborators

15 joint publications

Branko Ruscic

John F Stanton

Thanh Lam Nguyen

G Barney Ellison

C Franklin Goldsmith

David Feller

Lawrence B Harding

Jozef Peeters

James H Thorpe

Richard Dawes

Frequent Collaborators

15 joint publications

Branko Ruscic

6 joint publications

John F Stanton

4 joint publications

Thanh Lam Nguyen

3 joint publications

G Barney Ellison