SAMMS For Heavy Metal Removal - LDRD
EMSL Project ID
1163
Project Details
Project type
Exploratory Research
Start Date
1998-10-12
End Date
1999-09-30
Status
Closed
Released Data Link
Team
Principal Investigator
Related Publications
Andreas Heyden, Osman Mamun, Mohammad Saleheen, Mehdi Zare. 2021. "Aqueous-phase effects on ethanol decomposition over Ru-based catalysts." Catalysis Science & Technology https://doi.org/10.1039/D1CY01057C
Andreas Heyden, Subrata Kumar Kundu, Mohammad Saleheen, Mehdi Zare. 2020. "Dependency of solvation effects on metal identity in surface reactions." Communications Chemistry 3 (1) https://doi.org/10.1038/s42004-020-00428-4
Asif J. Chowdhury, Andreas Heyden, Gabriel A. Terejanu, Wenqiang Yang. 2021. "Comparative Study on the Machine Learning-Based Prediction of Adsorption Energies for Ring and Chain Species on Metal Catalyst Surfaces." The Journal of Physical Chemistry C 125 (32):17742-17748. https://doi.org/10.1021/acs.jpcc.1c05470
Charles Fricke, Andreas Heyden, Subrata Kumar Kundu, Biplab Rajbanshi, Wenqiang Yang, Adam Yonge. 2021. "Computational Investigation of the Catalytic Hydrodeoxygenation of Propanoic Acid over a Cu(111) Surface." The Journal of Physical Chemistry C 125 (35):19276-19293. https://doi.org/10.1021/acs.jpcc.1c05240
Chowdhury A.J., W. Yang, K.E. Abdelfatah, M. Zare, A. Heyden, and G.A. Terejanu. 2020. "A Multiple Filter Based Neural Network Approach to the Extrapolation of Adsorption Energies on Metal Surfaces for Catalysis Applications." Journal of Chemical Theory and Computation 16, no. 2:1105–1114.
Jesse Q. Bond, Andreas Heyden, Osman Mamun, Rajadurai Vijay Solomon, Wenqiang Yang. 2020. "Investigation of the reaction mechanism of the hydrodeoxygenation of propionic acid over a Rh(1 1 1) surface: A first principles study." Journal of Catalysis 391:98-110. https://doi.org/10.1016/j.jcat.2020.08.015
Rajbanshi B., S. Saha, S. Ammal, and A. Heyden. 2020. "Oxidative Dehydrogenation of Propane on the Oxygen Adsorbed Edges of Boron Nitride Nanoribbons." Catalysis Science & Technology 10, no. 15:5181-5195.
Xi Y., and A. Heyden. 2020. "Preferential Oxidation of CO in Hydrogen at Nonmetal Active Sites with High Activity and Selectivity." ACS Catalysis 10, 5362-5370. doi:10.1021/acscatal.0c00743
Xi Y., and A. Heyden. 2020. "Selective Activation of Methane CH Bond in the Presence of Methanol." Journal of Catalysis 386.
Yang W., R.V. Solomon, J. Lu, O. Mamun, J.Q. Bond, and A. Heyden. 2020. "Unraveling the Mechanism of the Hydrodeoxygenation of Propionic Acid Over a Pt (1 1 1) Surface in Vapor and Liquid Phases." Journal of Catalysis 381. doi:10.1016/j.jcat.2019.11.036
You K., S. Ammal, Z. Lin, W. Wan, J.G. Chen, and A. Heyden. 2020. "Understanding the Effect of Mo2C Support on the Activity of Cu for the Hydrodeoxygenation of Glycerol." Journal of Catalysis 388.
Zare M., R. V.. Solomon, W. Yang, A. Yonge, and A. Heyden. 2020. "Theoretical Investigation of Solvent Effects on the Hydrodeoxygenation of Propionic Acid over a Ni(111) Catalyst Model." Journal of Physical Chemistry C 124, 16488-16500. doi:10.1021/acs.jpcc.0c04437