Methanol Synthesis

• O2 Dissociation on Cu(111) Dynamics on a Novel Screened Hybrid van der Waals DFT Potential Energy Surface

  2024 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access

  3

  citations
• Multifunctionalized zirconium-based MOF as a novel support for dispersed copper: application in CO 2 adsorption and catalytic conversion

  2024 Journal of Materials Chemistry A article Chemistry Metal-Organic Frameworks: Synthesis and Applications Open access

  26

  citations
• Dissociative chemisorption of O 2 on Al(111): dynamics on a potential energy surface computed with a non-self-consistent screened hybrid density functional approach

  2024 Faraday Discussions article Physics and Astronomy Advanced Chemical Physics Studies Open access

  8

  citations
• Characterization of CO Adsorbed to Clean and Partially Oxidized Cu(211) and Cu(111)

  2023 The Journal of Physical Chemistry C article Materials Science Catalytic Processes in Materials Science Open access

  13

  citations
• Effect of surface temperature on quantum dynamics of D2 on Cu(111) using a chemically accurate potential energy surface

  2022 The Journal of Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access

  7

  citations
• RAIRS Characterization of CO and O Coadsorption on Cu(111)

  2022 The Journal of Physical Chemistry C article Materials Science Catalytic Processes in Materials Science Open access

  16

  citations
• Performance of Made Simple Meta-GGA Functionals with rVV10 Nonlocal Correlation for H 2 + Cu(111), D 2 + Ag(111), H 2 + Au(111), and D 2 + Pt(111)

  2021 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access

  23

  citations
• IR spectroscopic characterization of the co-adsorption of CO 2 and H 2 onto cationic Cu n + clusters

  2021 Physical Chemistry Chemical Physics article Chemical Engineering Catalysts for Methane Reforming Open access

  22

  citations
• Designing new SRP density functionals including non-local vdW-DF2 correlation for H 2 + Cu(111) and their transferability to H 2 + Ag(111), Au(111) and Pt(111)

  2020 Physical Chemistry Chemical Physics article Physics and Astronomy Advanced Chemical Physics Studies Open access

  18

  citations

9 results