UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

High-Throughput Screening of Metal–Organic Frameworks for Ethane–Ethylene Separation Using the Machine Learning Technique

Energy & fuels, 2020-11, Vol.34 (11), p.14591-14597

2020

Volltextzugriff (PDF)

Molecular Insights on Morphology, Composition, and Stability of Mixed Micelles Formed by Ionic Surfactant and Nonionic Block Copolymer in Water Using Coarse-Grained Molecular Dynamics Simulations

Langmuir, 2023-04, Vol.39 (14), p.5031-5040

2023

Volltextzugriff (PDF)

Ferrous sulfide and carboxyl-functionalized ferroferric oxide incorporated PVDF-based nanocomposite membranes for simultaneous removal of highly toxic heavy-metal ions from industrial ground water

Journal of membrane science, 2020-01, Vol.593, p.117422, Article 117422

2020

Volltextzugriff (PDF)

Accelerating In Silico Discovery of Metal–Organic Frameworks for Ethane/Ethylene and Propane/Propylene Separation: A Synergistic Approach Integrating Molecular Simulation, Machine Learning, and Active Learning

ACS applied materials & interfaces, 2024-02, Vol.16 (6), p.6971-6987

2024

Volltextzugriff (PDF)

Hydrogen adsorption in pyridine bridged porphyrin-covalent organic framework

International journal of hydrogen energy, 2019-01, Vol.44 (3), p.1782-1796

2019

Volltextzugriff (PDF)

Fusing a machine learning strategy with density functional theory to hasten the discovery of 2D MXene-based catalysts for hydrogen generation

Journal of materials chemistry. A, Materials for energy and sustainability, 2023-04, Vol.11 (15), p.891-81

2023

Volltextzugriff (PDF)

Magnetite-Coated Boron Nitride Nanosheets for the Removal of Arsenic(V) from Water

ACS applied materials & interfaces, 2019-05, Vol.11 (21), p.19017-19028

2019

Volltextzugriff (PDF)

Building Unit Extractor for Metal–Organic Frameworks

Journal of chemical information and modeling, 2021-12, Vol.61 (12), p.5827-5840

2021

Volltextzugriff (PDF)

Enhancement of Thermal Energy Transport across the Gold–Graphene Interface Using Nanoscale Defects: A Molecular Dynamics Study

Journal of physical chemistry. C, 2018-02, Vol.122 (4), p.2113-2121

2018

Volltextzugriff (PDF)

Separation of Ethanol and Water Using Graphene and Hexagonal Boron Nitride Slit Pores: A Molecular Dynamics Study

Journal of physical chemistry. C, 2017-04, Vol.121 (14), p.7867-7880

2017

Volltextzugriff (PDF)

Phase Behavior of Pure PSPC and PEGylated Multicomponent Lipid and Their Interaction with Paclitaxel: An All-Atom MD Study

Langmuir, 2021-08, Vol.37 (34), p.10259-10271

2021

Volltextzugriff (PDF)

Exploring the Anomalous Phase Behavior of High-Pressure Ices in Diamond Confinement

Journal of physical chemistry. C, 2020-03, Vol.124 (9), p.5460-5468

2020

Volltextzugriff (PDF)

Vapor−Liquid Phase Coexistence, Critical Properties, and Surface Tension of Confined Alkanes

Journal of physical chemistry. C, 2009-04, Vol.113 (17), p.7170-7180

2009

Volltextzugriff (PDF)

d‑SEAMS: Deferred Structural Elucidation Analysis for Molecular Simulations

Journal of chemical information and modeling, 2020-04, Vol.60 (4), p.2169-2177

2020

Volltextzugriff (PDF)

High-Throughput Screening of Atomic Defects in MXenes for CO2 Capture, Activation, and Dissociation

ACS applied materials & interfaces, 2021-08, Vol.13 (30), p.35585-35594

2021

Volltextzugriff (PDF)

Adsorptive Separation of CO2 from Multicomponent Mixtures of Flue Gas in Carbon Nanotube Arrays: A Grand Canonical Monte Carlo Study

Energy & fuels, 2018-05, Vol.32 (5), p.6090-6097

2018

Volltextzugriff (PDF)

Efficient CO2 Capture and Activation on Novel Two-Dimensional Transition Metal Borides

ACS applied materials & interfaces, 2022-07, Vol.14 (26), p.29703-29710

2022

Volltextzugriff (PDF)

Treatment of Flue Gas using Graphene Sponge: A Simulation Study

Journal of physical chemistry. C, 2018-07, Vol.122 (26), p.14654-14664

2018

Volltextzugriff (PDF)

Optimizing adsorption refrigeration with MOF-propane integration: a sustainable approach

Journal of materials chemistry. A, Materials for energy and sustainability, 2024-08, Vol.12 (32), p.21200-21212

2024

Volltextzugriff (PDF)

An efficient use of waste PE for hydrophobic surface coating and its application on cotton fibers for oil-water separator

Progress in organic coatings, 2019-06, Vol.131, p.301-310

2019

Volltextzugriff (PDF)

Underwater superoleophobic biomaterial based on waste potato peels for simultaneous separation of oil/water mixtures and dye adsorption

Cellulose (London), 2019-06, Vol.26 (9), p.5497-5511

2019

Volltextzugriff (PDF)

Does freezing induce self-assembly of polymers? A molecular dynamics study

Soft matter, 2023-10, Vol.19 (39), p.757-7579

2023

Volltextzugriff (PDF)

Salt-Water System under Diamond Confinement

Journal of physical chemistry. C, 2021-10, Vol.125 (40), p.22283-22294

2021

Volltextzugriff (PDF)

Machine-Learning-Driven High-Throughput Screening of Transition-Metal Atom Intercalated g‑C3N4/MX2 (M = Mo, W; X = S, Se, Te) Heterostructures for the Hydrogen Evolution Reaction

ACS applied materials & interfaces, 2024-03, Vol.16 (10), p.12437-12445

2024

Volltextzugriff (PDF)

Adsorption of Gadolinium (Gd3+) Ions on the Dibenzo Crown Ether (DBCE) and Dicyclo Hexano Crown Ether (DCHCE) Grafted on the Polystyrene Surface: Insights from All Atom Molecular Dynamics Simulations and Experiments

Journal of physical chemistry. C, 2019-05, Vol.123 (19), p.12276-12285

2019

Volltextzugriff (PDF)

1 – 25 von 246

Suche als RSS-Feed

Aktive Filter

ThemaTechnology

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(213)
Mit Volltextzugriff
(220)

Publikationsform

Sprache

Englisch
(246)

Erscheinungsjahr

n.n

Neu hinzugefügt

... seit 90 Tagen
(6)

Menü

Weitere Dienste

Einstellungen

High-Throughput Screening of Metal–Organic Frameworks for Ethane–Ethylene Separation Using the Machine Learning Technique

Molecular Insights on Morphology, Composition, and Stability of Mixed Micelles Formed by Ionic Surfactant and Nonionic Block Copolymer in Water Using Coarse-Grained Molecular Dynamics Simulations

Ferrous sulfide and carboxyl-functionalized ferroferric oxide incorporated PVDF-based nanocomposite membranes for simultaneous removal of highly toxic heavy-metal ions from industrial ground water

Accelerating In Silico Discovery of Metal–Organic Frameworks for Ethane/Ethylene and Propane/Propylene Separation: A Synergistic Approach Integrating Molecular Simulation, Machine Learning, and Active Learning

Hydrogen adsorption in pyridine bridged porphyrin-covalent organic framework

Fusing a machine learning strategy with density functional theory to hasten the discovery of 2D MXene-based catalysts for hydrogen generation

Magnetite-Coated Boron Nitride Nanosheets for the Removal of Arsenic(V) from Water

Building Unit Extractor for Metal–Organic Frameworks

Enhancement of Thermal Energy Transport across the Gold–Graphene Interface Using Nanoscale Defects: A Molecular Dynamics Study

Separation of Ethanol and Water Using Graphene and Hexagonal Boron Nitride Slit Pores: A Molecular Dynamics Study

Phase Behavior of Pure PSPC and PEGylated Multicomponent Lipid and Their Interaction with Paclitaxel: An All-Atom MD Study

Exploring the Anomalous Phase Behavior of High-Pressure Ices in Diamond Confinement

Vapor−Liquid Phase Coexistence, Critical Properties, and Surface Tension of Confined Alkanes

d‑SEAMS: Deferred Structural Elucidation Analysis for Molecular Simulations

High-Throughput Screening of Atomic Defects in MXenes for CO2 Capture, Activation, and Dissociation

Adsorptive Separation of CO2 from Multicomponent Mixtures of Flue Gas in Carbon Nanotube Arrays: A Grand Canonical Monte Carlo Study

Efficient CO2 Capture and Activation on Novel Two-Dimensional Transition Metal Borides

Treatment of Flue Gas using Graphene Sponge: A Simulation Study

Optimizing adsorption refrigeration with MOF-propane integration: a sustainable approach

An efficient use of waste PE for hydrophobic surface coating and its application on cotton fibers for oil-water separator

Underwater superoleophobic biomaterial based on waste potato peels for simultaneous separation of oil/water mixtures and dye adsorption

Does freezing induce self-assembly of polymers? A molecular dynamics study

Salt-Water System under Diamond Confinement

Machine-Learning-Driven High-Throughput Screening of Transition-Metal Atom Intercalated g‑C3N4/MX2 (M = Mo, W; X = S, Se, Te) Heterostructures for the Hydrogen Evolution Reaction

Adsorption of Gadolinium (Gd3+) Ions on the Dibenzo Crown Ether (DBCE) and Dicyclo Hexano Crown Ether (DCHCE) Grafted on the Polystyrene Surface: Insights from All Atom Molecular Dynamics Simulations and Experiments

Aktive Filter

Suchergebnisse filtern