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Rotational spectra and theoretical study of tetramers and trimers of 2-fluoroethanol: dramatic intermolecular compensation for intramolecular instability

Physical chemistry chemical physics : PCCP, 2018-11, Vol.20 (43), p.27630-27637

2018

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Structures of Cage, Prism, and Book Isomers of Water Hexamer from Broadband Rotational Spectroscopy

Science (American Association for the Advancement of Science), 2012-05, Vol.336 (6083), p.897-901

2012

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A Direct Link from the Gas to the Condensed Phase: A Rotational Spectroscopic Study of 2,2,2‐Trifluoroethanol Trimers

Angewandte Chemie International Edition, 2017-05, Vol.56 (22), p.6289-6293

International ed. in English, 2017

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Hydrogen Bond Cooperativity and the Three-Dimensional Structures of Water Nonamers and Decamers

Angewandte Chemie International Edition, 2014-12, Vol.53 (52), p.14368-14372

International ed. in English, 2014

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The gas-phase structure of the asymmetric, trans-dinitrogen tetroxide (N2O4), formed by dimerization of nitrogen dioxide (NO2), from rotational spectroscopy and ab initio quantum chemistry

The Journal of chemical physics, 2017-04, Vol.146 (13), p.134305-134305

2017

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Conformational Panorama and Chirality Controlled Structure–Energy Relationship in a Chiral Carboxylic Acid Dimer

Angewandte Chemie (International ed.), 2020-09, Vol.59 (36), p.15703-15710

International ed. in English, 2020

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Computational optimal transport for molecular spectra: The fully continuous case

The Journal of chemical physics, 2023-10, Vol.159 (16)

2023

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The rich conformational landscape of perillyl alcohol revealed by broadband rotational spectroscopy and theoretical modelling

Physical chemistry chemical physics : PCCP, 2019-07, Vol.21 (28), p.1548-15416

2019

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Computational optimal transport for molecular spectra: The fully discrete case

The Journal of chemical physics, 2021-11, Vol.155 (18), p.184101-184101

2021

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Computational optimal transport for molecular spectra: The semi-discrete case

The Journal of chemical physics, 2022-04, Vol.156 (13), p.134117-134117

2022

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Modifying conformational distribution of chiral tetrahydro-2-furoic acid through its interaction with water: a rotational spectroscopic and theoretical investigation

Physical chemistry chemical physics : PCCP, 2021-02, Vol.23 (6), p.382-3825

2021

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Structural study of 1- and 2-naphthol: new insights into the non-covalent H-H interaction in cis -1-naphthol

Physical chemistry chemical physics : PCCP, 2022-02, Vol.24 (6), p.3722-3732

2022

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The Chiral Trimer and a Metastable Chiral Dimer of Achiral Hexafluoroisopropanol: A Multi‐Messenger Study

Angewandte Chemie International Edition, 2019-04, Vol.58 (15), p.5080-5084

International ed. in English, 2019

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Alternating 1‑Phenyl-2,2,2-Trifluoroethanol Conformational Landscape With the Addition of One Water: Conformations and Large Amplitude Motions

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-10, Vol.126 (40), p.7250-7260

2022

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Rotational Spectroscopy of the 2,2,3,3,3‐Pentafluoropropanol⋅⋅⋅Water Complex: Conformations and Large Amplitude Motions

Chemphyschem, 2022-10, Vol.23 (20), p.e202200348-n/a

2022

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Dynamics of HCN, HNC, and HNCO Formation in the 193 nm Photodissociation of Formamide

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2024-09, Vol.128 (37), p.7761-7771

2024

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Twins in rotational spectroscopy: Does a rotational spectrum uniquely identify a molecule?

The Journal of chemical physics, 2024-07, Vol.161 (4)

2024

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Binary conformers of a flexible, long-chain fluoroalcohol: dispersion controlled selectivity and relative abundances in a jet

Physical chemistry chemical physics : PCCP, 2024-04, Vol.26 (14), p.1538-1545

2024

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A microwave spectroscopic and ab initio study of keto-enol tautomerism and isomerism in the cyclohexanone-water complex

Physical chemistry chemical physics : PCCP, 2019-06, Vol.21 (24), p.12872-12880

2019

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2,2,3,3,3-Pentafluoro-1-propanol and its dimer: structural diversity, conformational conversion, and tunnelling motion

Physical chemistry chemical physics : PCCP, 2022-06, Vol.24 (24), p.14975-14984

2022

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Broadband Fourier transform rotational spectroscopy for structure determination: The water heptamer

Chemical physics letters, 2013-05, Vol.571, p.1-15

2013

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Higher-Energy Hexafluoroisopropanol···Water Isomer and Its Large Amplitude Motions: Rotational Spectra and DFT Calculations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-12, Vol.125 (48), p.10401-10409

2021

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The 1‑Naphthol Dimer and Its Surprising Preference for π–π Stacking over Hydrogen Bonding

The journal of physical chemistry letters, 2019-06, Vol.10 (11), p.2836-2841

2019

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Rotational spectroscopy of chiral tetrahydro-2-furoic acid: Conformational landscape, conversion, and abundances

The Journal of chemical physics, 2018-12, Vol.149 (22), p.224306-224306

2018

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Rotational Spectrum and Molecular Structures of the Binary Aggregates of 1,1,1,3,3,3-Hexafluoro-2-propanol with Ne and Ar

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-06, Vol.125 (24), p.5355-5364

2021

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Rotational spectra and theoretical study of tetramers and trimers of 2-fluoroethanol: dramatic intermolecular compensation for intramolecular instability

Structures of Cage, Prism, and Book Isomers of Water Hexamer from Broadband Rotational Spectroscopy

A Direct Link from the Gas to the Condensed Phase: A Rotational Spectroscopic Study of 2,2,2‐Trifluoroethanol Trimers

Hydrogen Bond Cooperativity and the Three-Dimensional Structures of Water Nonamers and Decamers

The gas-phase structure of the asymmetric, trans-dinitrogen tetroxide (N2O4), formed by dimerization of nitrogen dioxide (NO2), from rotational spectroscopy and ab initio quantum chemistry

Conformational Panorama and Chirality Controlled Structure–Energy Relationship in a Chiral Carboxylic Acid Dimer

Computational optimal transport for molecular spectra: The fully continuous case

The rich conformational landscape of perillyl alcohol revealed by broadband rotational spectroscopy and theoretical modelling

Computational optimal transport for molecular spectra: The fully discrete case

Computational optimal transport for molecular spectra: The semi-discrete case

Modifying conformational distribution of chiral tetrahydro-2-furoic acid through its interaction with water: a rotational spectroscopic and theoretical investigation

Structural study of 1- and 2-naphthol: new insights into the non-covalent H-H interaction in cis -1-naphthol

The Chiral Trimer and a Metastable Chiral Dimer of Achiral Hexafluoroisopropanol: A Multi‐Messenger Study

Alternating 1‑Phenyl-2,2,2-Trifluoroethanol Conformational Landscape With the Addition of One Water: Conformations and Large Amplitude Motions

Rotational Spectroscopy of the 2,2,3,3,3‐Pentafluoropropanol⋅⋅⋅Water Complex: Conformations and Large Amplitude Motions

Dynamics of HCN, HNC, and HNCO Formation in the 193 nm Photodissociation of Formamide

Twins in rotational spectroscopy: Does a rotational spectrum uniquely identify a molecule?

Binary conformers of a flexible, long-chain fluoroalcohol: dispersion controlled selectivity and relative abundances in a jet

A microwave spectroscopic and ab initio study of keto-enol tautomerism and isomerism in the cyclohexanone-water complex

2,2,3,3,3-Pentafluoro-1-propanol and its dimer: structural diversity, conformational conversion, and tunnelling motion

Broadband Fourier transform rotational spectroscopy for structure determination: The water heptamer

Higher-Energy Hexafluoroisopropanol···Water Isomer and Its Large Amplitude Motions: Rotational Spectra and DFT Calculations

The 1‑Naphthol Dimer and Its Surprising Preference for π–π Stacking over Hydrogen Bonding

Rotational spectroscopy of chiral tetrahydro-2-furoic acid: Conformational landscape, conversion, and abundances

Rotational Spectrum and Molecular Structures of the Binary Aggregates of 1,1,1,3,3,3-Hexafluoro-2-propanol with Ne and Ar

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