Yan Zhao

Research interests

Publications

• Buried interface molecular hybrid for inverted perovskite solar cells

  Nature · 2024 · https://doi.org/10.1038/s41586-024-07723-3

• Ultrahigh Stable Methanol Oxidation Enabled by a High Hydroxyl Concentration on Pt Clusters/MXene Interfaces

  Journal of the American Chemical Society · 2022 · https://doi.org/10.1021/jacs.2c03982

• Reversely trapping atoms from a perovskite surface for high-performance and durable fuel cell cathodes

  Nature Catalysis · 2022 · https://doi.org/10.1038/s41929-022-00764-9

• Ligand Modulation of Active Sites to Promote Electrocatalytic Oxygen Evolution

  Advanced Materials · 2022 · https://doi.org/10.1002/adma.202200270

• Significant Improvements in Dielectric Constant and Energy Density of Ferroelectric Polymer Nanocomposites Enabled by Ultralow Contents of Nanofillers

  Advanced Materials · 2021 · https://doi.org/10.1002/adma.202102392

• Identification of Phase Control of Carbon‐Confined Nb2O5 Nanoparticles toward High‐Performance Lithium Storage

  Advanced Energy Materials · 2019 · https://doi.org/10.1002/aenm.201802695

• Irisin Stimulates Browning of White Adipocytes Through Mitogen-Activated Protein Kinase p38 MAP Kinase and ERK MAP Kinase Signaling

  Diabetes · 2013 · https://doi.org/10.2337/db13-1106

• Computational Thermochemistry: Scale Factor Databases and Scale Factors for Vibrational Frequencies Obtained from Electronic Model Chemistries

  Journal of Chemical Theory and Computation · 2010 · 10.1021/ct100326h

• Exploring the Limit of Accuracy of the Global Hybrid Meta Density Functional for Main-Group Thermochemistry, Kinetics, and Noncovalent Interactions

  Journal of Chemical Theory and Computation · 2008 · 10.1021/ct800246v

• Density Functionals with Broad Applicability in Chemistry

  Accounts of Chemical Research · 2008 · https://doi.org/10.1021/ar700111a

• The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

  Theoretical Chemistry Accounts · 2007 · https://doi.org/10.1007/s00214-007-0310-x

• Density Functional for Spectroscopy: No Long-Range Self-Interaction Error, Good Performance for Rydberg and Charge-Transfer States, and Better Performance on Average than B3LYP for Ground States

  The Journal of Physical Chemistry A · 2006 · 10.1021/jp066479k

• A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions

  The Journal of Chemical Physics · 2006 · https://doi.org/10.1063/1.2370993

• Design of Density Functionals by Combining the Method of Constraint Satisfaction with Parametrization for Thermochemistry, Thermochemical Kinetics, and Noncovalent Interactions

  Journal of Chemical Theory and Computation · 2006 · https://doi.org/10.1021/ct0502763

• Design of Density Functionals That Are Broadly Accurate for Thermochemistry, Thermochemical Kinetics, and Nonbonded Interactions

  The Journal of Physical Chemistry A · 2005 · https://doi.org/10.1021/jp050536c

• Hybrid Meta Density Functional Theory Methods for Thermochemistry, Thermochemical Kinetics, and Noncovalent Interactions: The MPW1B95 and MPWB1K Models and Comparative Assessments for Hydrogen Bonding and van der Waals Interactions

  The Journal of Physical Chemistry A · 2004 · 10.1021/jp048147q

Current projects

No projects listed.