Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

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Protocol for Identifying Accurate Collective Variables in Enhanced Molecular Dynamics Simulations for the Description of Structural Transformations in Flexible Metal-Organic Frameworks

P2860

Q58610768-2348AA39-27E9-4928-9D7E-FE4B9430E166

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Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

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2017 nî lūn-bûn

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2017年の論文

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2017年学术文章

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2017年学术文章

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2017年学术文章

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2017年学术文章

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Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

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Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

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Item

label

Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

@en

Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

@nl

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Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

@en

Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

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P1476

Reliably Modeling the Mechanic ...... ible Metal-Organic Frameworks.

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P2093

Sven M J Rogge

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A rationale for the large breathing of the porous aluminum terephthalate (MIL-53) upon hydration.

Large breathing effects in three-dimensional porous hybrid matter: facts, analyses, rules and consequences.

Mechanical properties of hybrid inorganic-organic framework materials: establishing fundamental structure-property relationships.

Carbon dioxide capture in metal-organic frameworks.

Structural studies of metal-organic frameworks under high pressure.

Metal-organic and covalent organic frameworks as single-site catalysts.

New synthetic routes towards MOF production at scale.

Exceptional Mechanical Stability of Highly Porous Zirconium Metal-Organic Framework UiO-66 and Its Important Implications.

Investigating the Pressure-Induced Amorphization of Zeolitic Imidazolate Framework ZIF-8: Mechanical Instability Due to Shear Mode Softening.

Thermodynamic Insight in the High-Pressure Behavior of UiO-66: Effect of Linker Defects and Linker Expansion.

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138-148

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scholarly article

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10.1021/ACS.ACCOUNTS.7B00404

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English

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http://www.w3.org/2001/XMLSchema#string

P478

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Michel Waroquier

Veronique Van Speybroeck

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2017-11-20T00:00:00Z

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29155552

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metal-organic framework

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5772196

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Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

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P2860

P2860

Reliably Modeling the Mechanical Stability of Rigid and Flexible Metal-Organic Frameworks.

description

name

type

label

prefLabel

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P50

P577

P698

P921

P932

P356

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P50

P577

P698

P921

P932