Daniel Bahamón

Khalifa University of Science and Technology

H指数:26

被引数:1,959

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Integrated molecular-to-process modelling of electrochemical furfural hydrogenation for sustainable biomass valorization

电化学糠醛加氢的集成分子-过程建模用于可持续生物质增值

Chemical Engineering Journal

IF13.2

2026-08-280

PRE

Role of B-site cation in Sr doped Nd1-xSrxBO3 (B = Mn, Fe) perovskite for two-step thermochemical CO2 splitting

Sr掺杂Nd1-xSrxBO3 (B = Mn, Fe)钙钛矿中B位阳离子的作用及其在两步热化学CO2分解中的作用

Fuel

IF7.5

2026-05-170

PRE

Mechanism of the electrochemical hydrogenation of graphene

石墨烯电化学氢化机制

Nature Communications

IF15.7

2025-11-280

OAAI

Insights into Proton Permeation Mechanism in Graphene and Graphene Oxide for PEM Fuel Cells

质子渗透机制在石墨烯和氧化石墨烯中用于PEM燃料电池的见解

ACS APPLIED ENERGY MATERIALS

IF5.5

2025-11-240

PRE

Ion-selective membranes: Highly efficient, robust, and superiorly selective

离子选择性膜：高效、耐用的，且具有优异的选择性

Journal of Membrane Science

IF9

2025-11-020

PRE

Competing CO2-H2O uptake and transfer across MOF@COF hybridized layered membranes − modeling equilibrium and transport properties towards Janus-like separation membranes

竞争性CO2-H2O吸收与传输通过MOF@COF杂化层状膜——模拟平衡与传输特性以实现类Janus分离膜

Chemical Engineering Science

IF4.3

2025-10-240

PRE

Multiscale design of tailored cathode materials for extended-capacity Li-O2 batteries

定制化正极材料的跨尺度设计用于扩展容量锂-氧电池

JOURNAL OF ENERGY STORAGE

IF9.8

2025-05-010

OAAI

Rational design of optimal bimetallic and trimetallic nickel-based single-atom alloys for bio-oil upgrading to hydrogen

针对生物油制氢过程的优化双金属和三金属镍基单原子合金的理性设计

NATURE COMMUNICATIONS

IF15.7

2025-03-180

Advanced computational modelling for biofuel catalyst optimization: enhancing beta zeolite acidity for oleic acid upgrading

BIOFUEL RESEARCH JOURNAL-BRJ

IF11.9

2024-09-010

Steering palm oil hydrodeoxygenation towards biofuel production: An experimental and theoretical approach to unveil periodic trends

MATERIALS TODAY CHEMISTRY

IF6.7

2024-09-010

PRE

Molecular dynamics simulations of the interfacial tension and the solubility of brine/H2 /CO2 systems: Implications for underground hydrogen storage

盐水/H2 /CO2系统的界面张力和溶解度的分子动力学模拟: 对地下储氢的影响

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

IF8.3

2024-08-0113

OAAI

Perspectives on Advancing Sustainable CO2 Conversion Processes: Trinomial Technology, Environment, and Economy

ACS SUSTAINABLE CHEMISTRY & ENGINEERING

IF7.3

2024-03-2212

Systematic screening of transition-metal-doped hydroxyapatite for efficient photocatalytic CO2 reduction

JOURNAL OF CO2 UTILIZATION

IF8.4

2024-02-010

OAAI

Molecular insights into the CO2 absorption mechanism by superbase protic ionic liquids by a combined density functional theory and molecular dynamics approach

JOURNAL OF MOLECULAR LIQUIDS

IF5.2

2024-01-017

PRE

Understanding the role of Ni-based single-atom alloys on the selective hydrodeoxygenation of bio-oils

了解镍基单原子合金对生物油选择性加氢脱氧的作用

FUEL PROCESSING TECHNOLOGY

IF7.7

2024-01-014

OAAI

Importance of Bridging Molecular and Process Modeling to Design Optimal Adsorbents for Large-Scale CO2 Capture

ACCOUNTS OF CHEMICAL RESEARCH

IF17.7

2023-12-290

OAAI

Exploring the Potential of Hierarchical Zeolite-Templated Carbon Materials for High-Performance Li-O2 Batteries: Insights from Molecular Simulations

ACS APPLIED MATERIALS & INTERFACES

IF8.2

2023-11-161

OAAI

A Systematic Approach to Understanding and Optimizing the CO2 Capture Performance of Triamine-Functionalized Mesoporous Silica with Amine Blends Molecular Simulations

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2023-04-064

PRE

Unprecedented photocatalytic conversion of gaseous and liquid CO2 on graphene-impregnated Pt/Cu-TiO2: The critical role of Cu dopant

JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING

IF7.2

2023-04-018

PRE

Insights into the mechanisms of H2S adsorption and dissociation on CdS surfaces by DFT-D3 calculations

通过DFT-D3计算了解H2S在CdS表面的吸附和解离机理

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

IF8.3

2023-03-018

PRE

Daniel Bahamón

个人简介

教育背景

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