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Quantum Crystallography in the Last Decade: Developments and Outlooks

Crystals (Basel), 2020-06, Vol.10 (6), p.473

2020

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Pitfalls in the location of guest molecules in metal-organic frameworks

Nature communications, 2022-09, Vol.13 (1), p.5288-5288, Article 5288

2022

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Putting pressure on aromaticity along with in situ experimental electron density of a molecular crystal

Nature communications, 2016-03, Vol.7 (1), p.10901-10901, Article 10901

2016

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Assessing the Limit of CO2 Storage in Seawater as Bicarbonate-Enriched Solutions

Molecules (Basel, Switzerland), 2024-08, Vol.29 (17), p.4069

2024

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Chemical Aspect of Ocean Liming for CO2 Removal: Dissolution Kinetics of Calcium Hydroxide in Seawater

ACS Engineering Au, 2024-08, Vol.4 (4), p.422-431

2024

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Magnetic order and enhanced exchange in the quasi-one-dimensional molecule-based antiferromagnet Cu(NO 3 ) 2 (pyz) 3

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (3), p.1014-1018

2019

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Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2

IUCrJ, 2018-01, Vol.5 (Pt 1), p.32-44

2018

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The Dielectric Behavior of Protected HKUST-1

Chemistry an international journal, 2022-06, Vol.4 (2), p.576-591

2022

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Extending Libraries of Extremely Localized Molecular Orbitals to Metal Organic Frameworks: A Preliminary Investigation

Crystals (Basel), 2021-02, Vol.11 (2), p.207

2021

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Comments on 'Hydrogen bonds in crystalline d-alanine: diffraction and spectroscopic evidence for differences between enantiomers'

IUCrJ, 2018-09, Vol.5 (Pt 5), p.654-657

2018

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Can X-ray constrained Hartree-Fock wavefunctions retrieve electron correlation?

IUCrJ, 2017-03, Vol.4 (Pt 2), p.136-146

2017

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The Role of Hydrogen Bond in Designing Molecular Optical Materials

Crystals (Basel), 2016-04, Vol.6 (4), p.43

2016

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Modelling the experimental electron density: only the synergy of various approaches can tackle the new challenges

IUCrJ, 2015-07, Vol.2 (Pt 4), p.441-451

2015

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Charge density analysis for crystal engineering

BMC chemistry, 2014-12, Vol.8 (1), Article 68

2014

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On generalized partition methods for interaction energies

Physical chemistry chemical physics : PCCP, 2020-11, Vol.22 (42), p.24291-24298

2020

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High pressure modification of organic NLO materials: large conformational re-arrangement of 4-aminobenzophenone

CrystEngComm, 2011-01, Vol.13 (22), p.6845-6849

2011

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High pressure behaviour of the organic semiconductor salt (TTF-BTD) 2 I 3

Physical chemistry chemical physics : PCCP, 2023-11, Vol.25 (45), p.31410-31417

2023

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High pressure behaviour of the organic semiconductor salt (TTF-BTD)I

Physical chemistry chemical physics : PCCP, 2023-11, Vol.25 (45), p.3141-31417

2023

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Chemical Aspect of Ocean Liming for CO 2 Removal: Dissolution Kinetics of Calcium Hydroxide in Seawater

ACS Engineering Au, 2024-08, Vol.4 (4), p.422-431

2024

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High pressure behaviour of the organic semiconductor salt (TTF-BTD)2I3

Physical chemistry chemical physics : PCCP, 2023-11, Vol.25 (45), p.31410-31417

2023

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Assessing the Limit of CO 2 Storage in Seawater as Bicarbonate-Enriched Solutions

Molecules (Basel, Switzerland), 2024-08, Vol.29 (17)

2024

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Optical properties of metal–organic networks from distributed atomic polarizabilities

CrystEngComm, 2016-01, Vol.18 (38), p.7339-7346

2016

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Magnetic order and enhanced exchange in the quasi-one-dimensional molecule-based antiferromagnet Cu(NO 3 ) 2 (pyz) 3

Physical chemistry chemical physics : PCCP, 2019-01, Vol.21 (3)

2019

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The α and β forms of oxalic acid di-hydrate at high pressure: a theoretical simulation and a neutron diffraction study

CrystEngComm, 2010-01, Vol.12 (9), p.2596

2010

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The Role of Hydrogen Bond in Designing Molecular Optical Materials

Crystals (Basel), 2016-01, Vol.6 (4), p.43-43

2016

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Quantum Crystallography in the Last Decade: Developments and Outlooks

Pitfalls in the location of guest molecules in metal-organic frameworks

Putting pressure on aromaticity along with in situ experimental electron density of a molecular crystal

Assessing the Limit of CO2 Storage in Seawater as Bicarbonate-Enriched Solutions

Chemical Aspect of Ocean Liming for CO2 Removal: Dissolution Kinetics of Calcium Hydroxide in Seawater

Magnetic order and enhanced exchange in the quasi-one-dimensional molecule-based antiferromagnet Cu(NO 3 ) 2 (pyz) 3

Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2

The Dielectric Behavior of Protected HKUST-1

Extending Libraries of Extremely Localized Molecular Orbitals to Metal Organic Frameworks: A Preliminary Investigation

Comments on 'Hydrogen bonds in crystalline d-alanine: diffraction and spectroscopic evidence for differences between enantiomers'

Can X-ray constrained Hartree-Fock wavefunctions retrieve electron correlation?

The Role of Hydrogen Bond in Designing Molecular Optical Materials

Modelling the experimental electron density: only the synergy of various approaches can tackle the new challenges

Charge density analysis for crystal engineering

On generalized partition methods for interaction energies

High pressure modification of organic NLO materials: large conformational re-arrangement of 4-aminobenzophenone

High pressure behaviour of the organic semiconductor salt (TTF-BTD) 2 I 3

High pressure behaviour of the organic semiconductor salt (TTF-BTD)I

Chemical Aspect of Ocean Liming for CO 2 Removal: Dissolution Kinetics of Calcium Hydroxide in Seawater

High pressure behaviour of the organic semiconductor salt (TTF-BTD)2I3

Assessing the Limit of CO 2 Storage in Seawater as Bicarbonate-Enriched Solutions

Optical properties of metal–organic networks from distributed atomic polarizabilities

Magnetic order and enhanced exchange in the quasi-one-dimensional molecule-based antiferromagnet Cu(NO 3 ) 2 (pyz) 3

The α and β forms of oxalic acid di-hydrate at high pressure: a theoretical simulation and a neutron diffraction study

The Role of Hydrogen Bond in Designing Molecular Optical Materials

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