Daniel G Kuroda

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 30

Top Topics

Molecular Dynamics Simulations

Top Venues

The journal of physical chemistry. B

The journal of physical chemistry. C, Nanomaterials and interfaces

The Journal of chemical physics

Chemical science

This page only lists publications with an associated author ORCID identifier.

Publications

Laura X Sepulveda-Montaño, Johan Fabian Galindo, Daniel G Kuroda
A new computational methodology for the characterization of complex molecular environments using IR spectroscopy: bridging the gap between experiments and computations. Chemical science (2024)
Ernest O Nachaki, Daniel G Kuroda
Lithium ion Speciation in Cyclic Solvents: Impact of Anion Charge Delocalization and Solvent Polarizability. The journal of physical chemistry. B (2024)
Ernest O Nachaki, Daniel G Kuroda
Transitioning from Regular Electrolytes to Solvate Ionic Liquids to High-Concentration Electrolytes: Changes in Transport Properties and Ionic Speciation. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (28) (2024)
Ernest O Nachaki, Daniel G Kuroda
Lithium ion Speciation in Cyclic Solvents: Impact of Anion Charge Delocalization and Solvent Polarizability. The journal of physical chemistry. B 128 (14) (2024)
Ernest O Nachaki, Daniel G Kuroda
Lithium ion Speciation in Cyclic Solvents: Impact of Anion Charge Delocalization and Solvent Polarizability. The journal of physical chemistry. B 128 (14) (2024)
Dodangodage Ishara Senadheera, Orlando Carrillo-Bohorquez, Ernest O Nachaki, Ryan Jorn, Daniel G Kuroda, Revati Kumar
Probing the Electrode-Electrolyte Interface of Sodium/Glyme-Based Battery Electrolytes. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (14) (2024)
Dodangodage Ishara Senadheera, Orlando Carrillo-Bohorquez, Ernest O Nachaki, Ryan Jorn, Daniel G Kuroda, Revati Kumar
Probing the Electrode-Electrolyte Interface of Sodium/Glyme-Based Battery Electrolytes. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (14) (2024)
Laura X Sepulveda-Montaño, Johan Fabian Galindo, Daniel G Kuroda
A new computational methodology for the characterization of complex molecular environments using IR spectroscopy: bridging the gap between experiments and computations. Chemical science (2024)
Ernest O Nachaki, Daniel G Kuroda
Lithium ion Speciation in Cyclic Solvents: Impact of Anion Charge Delocalization and Solvent Polarizability. The journal of physical chemistry. B 128 (14) (2024)
Dodangodage Ishara Senadheera, Orlando Carrillo-Bohorquez, Ernest O Nachaki, Ryan Jorn, Daniel G Kuroda, Revati Kumar
Probing the Electrode-Electrolyte Interface of Sodium/Glyme-Based Battery Electrolytes. The journal of physical chemistry. C, Nanomaterials and interfaces 128 (14) (2024)
Ernest O Nachaki, Daniel G Kuroda
Lithium ion Speciation in Cyclic Solvents: Impact of Anion Charge Delocalization and Solvent Polarizability. The journal of physical chemistry. B 128 (14) (2024)
Anit Gurung, Daniel G Kuroda
A new method based on pseudo-Zernike polynomials to analyze and extract dynamical and spectral information from the 2DIR spectra. The Journal of chemical physics 159 (3) (2023)
Jeramie C Rushing, Anit Gurung, Daniel G Kuroda
Relation between microscopic structure and macroscopic properties in polyacrylonitrile-based lithium-ion polymer gel electrolytes. The Journal of chemical physics 158 (14) (2023)
Xiaobing Chen, Daniel G Kuroda
Ionic conduction mechanism in high concentration lithium ion electrolytes. Chemical communications (Cambridge, England) (2023)
Laura X Sepulveda-Montaño, Johan Fabian Galindo, Daniel G Kuroda
Infrared Spectroscopy of Liquid Solutions as a Benchmarking Tool of Semiempirical QM Methods: The Case of GFN2-xTB. The journal of physical chemistry. B (2023)
Xiaobing Chen, Daniel G Kuroda
Ionic conduction mechanism in high concentration lithium ion electrolytes. Chemical communications (Cambridge, England) 59 (13) (2023)
Jeramie C Rushing, Callie M Stern, Noémie Elgrishi, Daniel G Kuroda
Tale of a "Non-interacting" Additive in a Lithium-Ion Electrolyte: Effect on Ionic Speciation and Electrochemical Properties. The journal of physical chemistry. C, Nanomaterials and interfaces 126 (4) (2022)
Ernest O Nachaki, Fedra M Leonik, Daniel G Kuroda
Effect of the N -Alkyl Side Chain on the Amide-Water Interactions. The journal of physical chemistry. B 126 (41) (2022)
Xiaoliu Zhang, Shengmin Zhou, Fedra M Leonik, Lu Wang, Daniel G Kuroda
Quantum mechanical effects in acid-base chemistry. Chemical science 13 (23) (2022)
Xiaoliu Zhang, Xiaobing Chen, Daniel G Kuroda
Computing the frequency fluctuation dynamics of highly coupled vibrational transitions using neural networks. The Journal of chemical physics 154 (16) (2021)
Yaowen Cui, Jeramie C Rushing, Soenke Seifert, Nicholas M Bedford, Daniel G Kuroda
Structural and dynamical changes observed when transitioning from an ionic liquid to a deep eutectic solvent. The Journal of chemical physics 155 (5) (2021)
Susith R Galle Kankanamge, Daniel G Kuroda
Molecular Structure, Chemical Exchange, and Conductivity Mechanism of High Concentration LiTFSI Electrolytes. The journal of physical chemistry. B 124 (10) (2020)
Xiaobing Chen, Daniel G Kuroda
Molecular motions of acetonitrile molecules in the solvation shell of lithium ions. The Journal of chemical physics 153 (16) (2020)
Habtom B Gobeze, Jianbo Ma, Fedra M Leonik, Daniel G Kuroda
Bottom-Up Approach to Assess the Molecular Structure of Aqueous Poly(N-Isopropylacrylamide) at Room Temperature via Infrared Spectroscopy. The journal of physical chemistry. B 124 (51) (2020)
Susith R Galle Kankanamge, Jianbo Ma, Robert T Mackin, Fedra M Leonik, Carol M Taylor, Igor V Rubtsov, Daniel G Kuroda
Proving and Probing the Presence of the Elusive C-H⋅⋅⋅O Hydrogen Bond in Liquid Solutions at Room Temperature. Angewandte Chemie (International ed. in English) 59 (39) (2020)
Xiaobing Chen, Yaowen Cui, Habtom B Gobeze, Daniel G Kuroda
Assessing the Location of Ionic and Molecular Solutes in a Molecularly Heterogeneous and Nonionic Deep Eutectic Solvent. The journal of physical chemistry. B 124 (23) (2020)
Xiaobing Chen, Kristen D Fulfer, Kaylee T Woodard, Daniel G Kuroda
Structure and Dynamics of the Lithium-Ion Solvation Shell in Ureas. The journal of physical chemistry. B 123 (46) (2019)
Yaowen Cui, Jeramie C Rushing, Soenke Seifert, Nicholas M Bedford, Daniel G Kuroda
Molecularly Heterogeneous Structure of a Nonionic Deep Eutectic Solvent Composed of N-Methylacetamide and Lauric Acid. The journal of physical chemistry. B 123 (18) (2019)
Yaowen Cui, Daniel G Kuroda
Evidence of Molecular Heterogeneities in Amide-Based Deep Eutectic Solvents. The journal of physical chemistry. A 122 (5) (2018)
Yaowen Cui, Mei-Chun Li, Qinglin Wu, John A Pojman, Daniel G Kuroda
Synthesis-Free Phase-Selective Gelator for Oil-Spill Remediation. ACS applied materials & interfaces 9 (39) (2017)