David H. Bross
Argonne National Laboratory(US)
Publications by Year
Research Areas
Chemical Thermodynamics and Molecular Structure, Advanced Chemical Physics Studies, Machine Learning in Materials Science, thermodynamics and calorimetric analyses, Phase Equilibria and Thermodynamics
Most-Cited Works
- → Explicitly correlated composite thermochemistry of transition metal species(2013)107 cited
- → Correlation consistent, Douglas–Kroll–Hess relativistic basis sets for the 5p and 6p elements(2013)91 cited
- → High-accuracy extrapolated ab initio thermochemistry. IV. A modified recipe for computational efficiency(2019)89 cited
- → Thermochemistry(2019)57 cited
- → Substitution Reactions in the Pyrolysis of Acetone Revealed through a Modeling, Experiment, Theory Paradigm(2021)54 cited
- → Active Thermochemical Tables: The Adiabatic Ionization Energy of Hydrogen Peroxide(2017)40 cited
- → Enthalpy of Formation of N2H4 (Hydrazine) Revisited(2017)38 cited
- → Composite thermochemistry of gas phase U(VI)-containing molecules(2014)37 cited
- → Thermal Decomposition of Potential Ester Biofuels. Part I: Methyl Acetate and Methyl Butanoate(2017)36 cited
- → Elaborated thermochemical treatment of HF, CO, N2, and H2O: Insight into HEAT and its extensions(2021)33 cited