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Theoretical study of putrescine and X12Y12 (X=Al, B and Y=N, P) nanocage interactions

Journal of nanoparticle research : an interdisciplinary forum for nanoscale science and technology, 2021-04, Vol.23 (4), Article 108

2021

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A detailed theoretical study of the low-energy structures of Au–Ag bimetallic clusters

Journal of nanoparticle research : an interdisciplinary forum for nanoscale science and technology, 2022-03, Vol.24 (3), Article 46

2022

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Application of AgPt Nanoshells in Direct Methanol Fuel Cells: Experimental and Theoretical Insights of Design Electrocatalysts over Methanol Crossover Effect

ChemCatChem, 2022-12, Vol.14 (23), p.n/a

2022

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Galvanic replacement managing direct methanol fuel cells: AgPt nanotubes as a strategy for methanol crossover effect tolerance

Journal of materials science, 2022-05, Vol.57 (17), p.8225-8240

2022

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DFT Analysis of Dynamic, Charge, and TD-DFT Properties of Doped, Encapsulated, and Decorated First-Row Transition Metals on B12N12 Nanocage: Part 2

Journal of inorganic and organometallic polymers and materials, 2024, Vol.34 (8), p.3576-3588

2024

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Putrescine adsorption on pristine and Cu-decorated B12N12 nanocages: A density functional theory study

Computational and theoretical chemistry, 2022-09, Vol.1215, p.113836, Article 113836

2022

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A Detailed Theoretical Study of Cu3Agm Bimetallic Clusters

Orbital : The Electronic Journal of Chemistry, 2021-04, Vol.13 (3), p.212-218

2021

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Correlating composition and electronic effects of self-assembled PtMo electrocatalysts for ethylene glycol oxidation: An experimental and theoretical approach

International journal of hydrogen energy, 2023-10, Vol.48 (87), p.33875-33885

2023

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Electrooxidation of ethylene glycol using Ag-Pt nanotubes supported on silica: Correlating the unexpected O-vacancies creation with catalytic performance

Catalysis today, 2024-11, Vol.441, p.114914, Article 114914

2024

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Structural and electronic properties of FeCl3 and CrO3 interacting with GaP nanotubes from DFT calculations

New journal of chemistry, 2021-06, Vol.45 (21), p.9483-9490

2021

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DFT Analysis of Structural, Energetic and Electronic Properties of Doped, Encapsulated, and Decorated First-Row Transition Metals on B12N12 Nanocage: Part 1

Journal of inorganic and organometallic polymers and materials, 2024-04

2024

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Cu-modified B12N12 nanocage as a chemical sensor for nitrogen monoxide gas: a density functional theory study

Journal of nanoparticle research : an interdisciplinary forum for nanoscale science and technology, 2023-12, Vol.25 (12), p.248, Article 248

2023

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A Detailed Theoretical Study of [Cu.sub.3][Ag.sub.m] Bimetallic Clusters

Orbital : The Electronic Journal of Chemistry, 2021-04, Vol.13 (3), p.212

2021

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Structural and electronic properties of FeCl and CrO interacting with GaP nanotubes from DFT calculations

New journal of chemistry, 2021-06, Vol.45 (21), p.9483-949

2021

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Structural and electronic properties of FeCl 3 and CrO 3 interacting with GaP nanotubes from DFT calculations

New journal of chemistry, 2021-06, Vol.45 (21), p.9483-9490

2021

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Front Cover: Application of AgPt Nanoshells in Direct Methanol Fuel Cells: Experimental and Theoretical Insights of Design Electrocatalysts over Methanol Crossover Effect (ChemCatChem 23/2022)

ChemCatChem, 2022-12, Vol.14 (23), p.n/a

2022

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A Detailed Theoretical Study of Cu3Agm Bimetallic Clusters

Orbital : The Electronic Journal of Chemistry, 2021-07, Vol.13 (3)

2021

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Generation of models from existing models composition: An application to agrarian sciences

PloS one, 2019-12, Vol.14 (12), p.e0214778-e0214778

2019

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Challenge in the Discovery of New Drugs: Antimicrobial Peptides against WHO-List of Critical and High-Priority Bacteria

Pharmaceutics, 2021-05, Vol.13 (6), p.773

2021

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Urban Flooding in Brazil

1, 2023

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Bonding of Steel Bars in Concrete with the Addition of Carbon Nanotubes: A Systematic Review of the Literature

Buildings (Basel), 2022-10, Vol.12 (10), p.1626

2022

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Effect of Flexible Family Visitation on Delirium Among Patients in the Intensive Care Unit: The ICU Visits Randomized Clinical Trial

JAMA : the journal of the American Medical Association, 2019-07, Vol.322 (3), p.216

2019

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Soluciones Basadas en la Naturaleza y el diálogo sectorial entre Brasil-Unión europea

Revista de estudios brasileños, 2023-06, Vol.8 (17), p.191-204

2023

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Accelerating Conjugate Heat Transfer Simulations in Squared Heated Cavities through Graphics Processing Unit (GPU) Computing

Computation, 2024-05, Vol.12 (5), p.106

2024

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Study protocol to assess the effectiveness and safety of a flexible family visitation model for delirium prevention in adult intensive care units: a cluster-randomised, crossover trial (The ICU Visits Study)

BMJ open, 2018-04, Vol.8 (4), p.e021193-e021193

2018

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Theoretical study of putrescine and X12Y12 (X=Al, B and Y=N, P) nanocage interactions

A detailed theoretical study of the low-energy structures of Au–Ag bimetallic clusters

Application of AgPt Nanoshells in Direct Methanol Fuel Cells: Experimental and Theoretical Insights of Design Electrocatalysts over Methanol Crossover Effect

Galvanic replacement managing direct methanol fuel cells: AgPt nanotubes as a strategy for methanol crossover effect tolerance

DFT Analysis of Dynamic, Charge, and TD-DFT Properties of Doped, Encapsulated, and Decorated First-Row Transition Metals on B12N12 Nanocage: Part 2

Putrescine adsorption on pristine and Cu-decorated B12N12 nanocages: A density functional theory study

A Detailed Theoretical Study of Cu3Agm Bimetallic Clusters

Correlating composition and electronic effects of self-assembled PtMo electrocatalysts for ethylene glycol oxidation: An experimental and theoretical approach

Electrooxidation of ethylene glycol using Ag-Pt nanotubes supported on silica: Correlating the unexpected O-vacancies creation with catalytic performance

Structural and electronic properties of FeCl3 and CrO3 interacting with GaP nanotubes from DFT calculations

DFT Analysis of Structural, Energetic and Electronic Properties of Doped, Encapsulated, and Decorated First-Row Transition Metals on B12N12 Nanocage: Part 1

Cu-modified B12N12 nanocage as a chemical sensor for nitrogen monoxide gas: a density functional theory study

A Detailed Theoretical Study of [Cu.sub.3][Ag.sub.m] Bimetallic Clusters

Structural and electronic properties of FeCl and CrO interacting with GaP nanotubes from DFT calculations

Structural and electronic properties of FeCl 3 and CrO 3 interacting with GaP nanotubes from DFT calculations

Front Cover: Application of AgPt Nanoshells in Direct Methanol Fuel Cells: Experimental and Theoretical Insights of Design Electrocatalysts over Methanol Crossover Effect (ChemCatChem 23/2022)

A Detailed Theoretical Study of Cu3Agm Bimetallic Clusters

Generation of models from existing models composition: An application to agrarian sciences

Challenge in the Discovery of New Drugs: Antimicrobial Peptides against WHO-List of Critical and High-Priority Bacteria

Urban Flooding in Brazil

Bonding of Steel Bars in Concrete with the Addition of Carbon Nanotubes: A Systematic Review of the Literature

Effect of Flexible Family Visitation on Delirium Among Patients in the Intensive Care Unit: The ICU Visits Randomized Clinical Trial

Soluciones Basadas en la Naturaleza y el diálogo sectorial entre Brasil-Unión europea

Accelerating Conjugate Heat Transfer Simulations in Squared Heated Cavities through Graphics Processing Unit (GPU) Computing

Study protocol to assess the effectiveness and safety of a flexible family visitation model for delirium prevention in adult intensive care units: a cluster-randomised, crossover trial (The ICU Visits Study)

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