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Understanding Intrinsic Light Absorption Properties of UiO-66 Frameworks: A Combined Theoretical and Experimental Study

Inorganic chemistry, 2015-11, Vol.54 (22), p.10701-10710

2015

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First-Principles Study of Antisite Defect Configurations in ZnGa2O4:Cr Persistent Phosphors

Inorganic chemistry, 2016-03, Vol.55 (5), p.2402-2412

2016

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UV-Curable Biobased Polyacrylates Based on a Multifunctional Monomer Derived from Furfural

Macromolecules, 2020-02, Vol.53 (4), p.1388-1404

2020

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A Flexible Photoactive Titanium Metal-Organic Framework Based on a [TiIV3(μ3-O)(O)2(COO)6] Cluster

Angewandte Chemie (International ed.), 2015-11, Vol.54 (47), p.13912-13917

International ed. in English, 2015

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Assigning probabilities to non-Lipschitz mechanical systems

Chaos (Woodbury, N.Y.), 2021-12, Vol.31 (12)

2021

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Extending Hirshfeld-I to bulk and periodic materials

Journal of computational chemistry, 2013-02, Vol.34 (5), p.405-417

2013

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Convergence of Atomic Charges with the Size of the Enzymatic Environment

Journal of chemical information and modeling, 2015-03, Vol.55 (3), p.564-571

2015

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Deep Eutectic Solvents as Nonflammable Electrolytes for Durable Sodium‐Ion Batteries

Advanced energy and sustainability research, 2022-03, Vol.3 (3), p.n/a

2022

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Reply to 'comment on "extending Hirshfeld-I to bulk and periodic materials"'

Journal of computational chemistry, 2013-02, Vol.34 (5), p.422-427

2013

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On the influence of water on THz vibrational spectral features of molecular crystals

Physical chemistry chemical physics : PCCP, 2022-03, Vol.24 (10), p.6107-6125

2022

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Quasi-1D physics in metal-organic frameworks: MIL-47(V) from first principles

Beilstein journal of nanotechnology, 2014-10, Vol.5 (1), p.1738-1748

2014

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Mechanical Properties from Periodic Plane Wave Quantum Mechanical Codes: The Challenge of the Flexible Nanoporous MIL-47(V) Framework

Journal of physical chemistry. C, 2015-10, Vol.119 (41), p.23752-23766

2015

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Linker Functionalization in MIL-47(V)‑R Metal–Organic Frameworks: Understanding the Electronic Structure

Journal of physical chemistry. C, 2017-04, Vol.121 (14), p.8014-8022

Vanpoucke, Danny E. P

2017

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Investigation of structural, electronic and magnetic properties of breathing metal-organic framework MIL-47(Mn): a first principles approach

RSC advances, 2020-01, Vol.10 (8), p.4786-4794

2020

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Impact of methane concentration on surface morphology and boron incorporation of heavily boron-doped single crystal diamond layers

Carbon (New York), 2021-02, Vol.172, p.463-473

2021

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Modeling 1D structures on semiconductor surfaces: synergy of theory and experiment

Journal of physics. Condensed matter, 2014-04, Vol.26 (13), p.133001-133001

Vanpoucke, Danny E P

2014

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Mechanochemical synthesis of nanostructured metal nitrides, carbonitrides and carbon nitride: a combined theoretical and experimental study

Physical chemistry chemical physics : PCCP, 2017-05, Vol.19 (19), p.12414-12424

2017

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New Functionalized Metal–Organic Frameworks MIL-47‑X (X = −Cl, −Br, −CH3, −CF3, −OH, −OCH3): Synthesis, Characterization, and CO2 Adsorption Properties

Journal of physical chemistry. C, 2013-11, Vol.117 (44), p.22784-22796

2013

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Can europium atoms form luminescent centres in diamond: A combined theoretical–experimental study

Diamond and related materials, 2019-04, Vol.94, p.233-241

2019

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Localized vibrational modes of GeV-centers in diamond: Photoluminescence and first-principles phonon study

Diamond and related materials, 2022-06, Vol.126, p.109049, Article 109049

2022

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Influence of diamond crystal orientation on the interaction with biological matter

Carbon (New York), 2020-06, Vol.162, p.1-12

2020

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Synthesis, characterization and thermodynamic stability of nanostructured ε-iron carbonitride powder prepared by a solid-state mechanochemical route

Journal of alloys and compounds, 2019-03, Vol.778, p.327-336

2019

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Comment on 'Europium doping induced symmetry deviation and its impact on the second harmonic generation of doped ZnO nanowires'

Nanotechnology, 2014-11, Vol.25 (45), p.458001-458001

Vanpoucke, Danny E P

2014

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A machine learning approach for the design of hyperbranched polymeric dispersing agents based on aliphatic polyesters for radiation‐curable inks

Polymer international, 2022-08, Vol.71 (8), p.966-975

2022

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Tuning of CeO2 buffer layers for coated superconductors through doping

Applied surface science, 2012-11, Vol.260, p.32-35

2012

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Understanding Intrinsic Light Absorption Properties of UiO-66 Frameworks: A Combined Theoretical and Experimental Study

First-Principles Study of Antisite Defect Configurations in ZnGa2O4:Cr Persistent Phosphors

UV-Curable Biobased Polyacrylates Based on a Multifunctional Monomer Derived from Furfural

A Flexible Photoactive Titanium Metal-Organic Framework Based on a [TiIV3(μ3-O)(O)2(COO)6] Cluster

Assigning probabilities to non-Lipschitz mechanical systems

Extending Hirshfeld-I to bulk and periodic materials

Convergence of Atomic Charges with the Size of the Enzymatic Environment

Deep Eutectic Solvents as Nonflammable Electrolytes for Durable Sodium‐Ion Batteries

Reply to 'comment on "extending Hirshfeld-I to bulk and periodic materials"'

On the influence of water on THz vibrational spectral features of molecular crystals

Quasi-1D physics in metal-organic frameworks: MIL-47(V) from first principles

Mechanical Properties from Periodic Plane Wave Quantum Mechanical Codes: The Challenge of the Flexible Nanoporous MIL-47(V) Framework

Linker Functionalization in MIL-47(V)‑R Metal–Organic Frameworks: Understanding the Electronic Structure

Investigation of structural, electronic and magnetic properties of breathing metal-organic framework MIL-47(Mn): a first principles approach

Impact of methane concentration on surface morphology and boron incorporation of heavily boron-doped single crystal diamond layers

Modeling 1D structures on semiconductor surfaces: synergy of theory and experiment

Mechanochemical synthesis of nanostructured metal nitrides, carbonitrides and carbon nitride: a combined theoretical and experimental study

New Functionalized Metal–Organic Frameworks MIL-47‑X (X = −Cl, −Br, −CH3, −CF3, −OH, −OCH3): Synthesis, Characterization, and CO2 Adsorption Properties

Can europium atoms form luminescent centres in diamond: A combined theoretical–experimental study

Localized vibrational modes of GeV-centers in diamond: Photoluminescence and first-principles phonon study

Influence of diamond crystal orientation on the interaction with biological matter

Synthesis, characterization and thermodynamic stability of nanostructured ε-iron carbonitride powder prepared by a solid-state mechanochemical route

Comment on 'Europium doping induced symmetry deviation and its impact on the second harmonic generation of doped ZnO nanowires'

A machine learning approach for the design of hyperbranched polymeric dispersing agents based on aliphatic polyesters for radiation‐curable inks

Tuning of CeO2 buffer layers for coated superconductors through doping

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