Publikationen von Yuki Nagata
Alle Typen
Zeitschriftenartikel (95)
21.
Zeitschriftenartikel
11 (15), S. 9962 - 9969 (2021)
Polyethylene Glycol Covered Sn Catalysts Accelerate the Formation Rate of Formate by Carbon Dioxide Reduction. ACS Catalysis 22.
Zeitschriftenartikel
125 (25), S. 7060 - 7067 (2021)
Disentangling Sum-Frequency Generation Spectra of the Water Bending Mode at Charged Aqueous Interfaces. The Journal of Physical Chemistry B 23.
Zeitschriftenartikel
27 (26), S. 7402 - 7407 (2021)
Specific Ion‐Protein Interactions Influence Bacterial Ice Nucleation. Chemistry – A European Journal 24.
Zeitschriftenartikel
23 (13), S. 7714 - 7723 (2021)
Vibrational energy relaxation of interfacial OH on a water-covered ɑ-Al2O3(0001) surface: a non-equilibrium ab initio molecular dynamics study. Physical Chemistry Chemical Physics 25.
Zeitschriftenartikel
12 (1), 203 (2021)
Catalytic activity of graphene-covered non-noble metals governed by proton penetration in electrochemical hydrogen evolution reaction. Nature Communications 26.
Zeitschriftenartikel
22 (19), S. 10934 - 10940 (2020)
Decoding the molecular water structure at complex interfaces through surface-specific spectroscopy of the water bending mode. Physical Chemistry Chemical Physics 27.
Zeitschriftenartikel
120 (8), S. 3633 - 3667 (2020)
Molecular Structure and Modeling of Water-Air and Ice-Air Interfaces Monitored by Sum-Frequency Generation. Chemical Reviews 28.
Zeitschriftenartikel
11, 1611 (2020)
Macroscopic conductivity of aqueous electrolyte solutions scales with ultrafast microscopic ion motions. Nature Communications 29.
Zeitschriftenartikel
118 (4), 1620358 (2020)
Impact of intermolecular vibrational coupling effects on the sum-frequency generation spectra of the water/air interface. Molecular Physics 30.
Zeitschriftenartikel
142 (2), S. 945 - 952 (2020)
Nature of Excess Hydrated Proton at the Water–Air Interface. Journal of the American Chemical Society 31.
Zeitschriftenartikel
11 (19), S. 8459 - 8469 (2020)
The Bending Mode of Water: A Powerful Probe for Hydrogen Bond Structure of Aqueous Systems. The Journal of Physical Chemistry Letters 32.
Zeitschriftenartikel
11 (1), 5977 (2020)
Vibrational couplings and energy transfer pathways of water's bending mode. Nature Communications 33.
Zeitschriftenartikel
22 (22), S. 12785 - 12793 (2020)
Vibrational mode frequency correction of liquid water in density functional theory molecular dynamics simulations with van der Waals correction. Physical Chemistry Chemical Physics 34.
Zeitschriftenartikel
10 (1), S. 792 - 799 (2019)
Effect of Graphene Encapsulation of NiMo Alloys on Oxygen Evolution Reaction. ACS Catalysis 35.
Zeitschriftenartikel
10 (21), S. 6936 - 6941 (2019)
Unveiling Heterogeneity of Interfacial Water through the Water Bending Mode. The Journal of Physical Chemistry Letters 36.
Zeitschriftenartikel
10 (17), S. 4914 - 4919 (2019)
Accessing the Accuracy of Density Functional Theory through Structure and Dynamics of the Water–Air Interface. The Journal of Physical Chemistry Letters 37.
Zeitschriftenartikel
150 (24), 244701 (2019)
Vibrational spectra of dissociatively adsorbed D2O on Al-terminated α-Al2O3(0001) surfaces from ab initio molecular dynamics. The Journal of Chemical Physics 38.
Zeitschriftenartikel
58 (1), S. 332 - 337 (2019)
Specific Ion Effects on an Oligopeptide: Bidentate binding matters for the Guanidinium Cation. Angewandte Chemie International Edition 39.
Zeitschriftenartikel
131 (1), S. 338 - 343 (2019)
Spezifische Ionen‐Effekte am Beispiel eines Oligopeptids: die Rolle zweizähniger Koordination beim Guanidinium‐Kation. Angewandte Chemie 40.
Zeitschriftenartikel
15 (6), S. 3836 - 3843 (2019)
Structure and Dynamics of Water at the Water-Air Interface Using First-Principles Molecular Dynamics Simulations. II. NonLocal vs Empirical van der Waals Corrections. Journal of Chemical Theory and Computation