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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, Vol.20 (43), p.27630-27637

2018

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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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Competition Between Intra‐ and Intermolecular Hydrogen Bonding: o‐Anisic Acid⋅⋅⋅Formic Acid Heterodimer

Chemistry : a European journal, 2019-09, Vol.25 (53), p.12325-12331

2019

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IR, Raman, and Vibrational Optical Activity Spectra of Methyl Glycidate in Chloroform and Water: The Clusters‐in‐a‐liquid Solvation Model

Chemphyschem, 2018-09, Vol.19 (17), p.2234-2242

2018

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Unusual H-Bond Topology and Bifurcated H-bonds in the 2-Fluoroethanol Trimer

Angewandte Chemie (International ed.), 2015-09, Vol.54 (40), p.11711-11715

International ed. in English, 2015

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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 ed.), 2017-05, Vol.56 (22), p.6289-6293

International ed. in English, 2017

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Structure and tunneling dynamics in a model system of peptide co-solvents: rotational spectroscopy of the 2,2,2-trifluoroethanol⋯water complex

The Journal of chemical physics, 2014-06, Vol.140 (23), p.234307-234307

2014

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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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Structural and dynamical features of the 2,2,2-trifluoroethanol ammonia complex

Physical chemistry chemical physics : PCCP, 2020-10, Vol.22 (4), p.2319-2327

2020

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Direct Spectroscopic Detection of the Orientation of Free OH Groups in Methyl Lactate-(Water)1,2 Clusters: Hydration of a Chiral Hydroxy Ester

Angewandte Chemie (International ed.), 2014-01, Vol.53 (4), p.1156-1159

International ed. in English, 2014

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Rotational spectra of two six-membered heterocyclic N-methyl-piperidinol compounds: Conformations by OH rotation, N-methyl inversion, and ring puckering

The Journal of chemical physics, 2017-03, Vol.146 (10), p.104303-104303

2017

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Rotational spectroscopy of the methyl glycidate-water complex: conformation and water and methyl rotor tunnelling motions

Physical chemistry chemical physics : PCCP, 2017, Vol.19 (43), p.29508-29515

2017

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The Clusters-in-a-Liquid Approach for Solvation: New Insights from the Conformer Specific Gas Phase Spectroscopy and Vibrational Optical Activity Spectroscopy

Frontiers in chemistry, 2016-02, Vol.4, p.9-9

2016

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Chirality Synchronization in Trifluoroethanol Dimer Revisited: The Missing Heterochiral Dimer

The journal of physical chemistry letters, 2014-06, Vol.5 (11), p.1850-1855

2014

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Tunnelling and barrier-less motions in the 2-fluoroethanol-water complex: a rotational spectroscopic and ab initio study

Physical chemistry chemical physics : PCCP, 2017-05, Vol.19 (19), p.12221-12228

2017

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Thermomechanical responses of microfluidic cantilever capture DNA melting and properties of DNA premelting states using picoliters of DNA solution

Applied physics letters, 2019-04, Vol.114 (17)

2019

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Rotational spectra and theoretical study of tetramers and trimers of 2-fluoroethanol: dramatic intermolecular compensation for intramolecular instabilityElectronic supplementary information (ESI) available: List of observed rotational transition frequencies; QTAIM and NCI analyses of I-III and QTAIM interaction energies of I-V; optimized geometries of I-V; completion of references. See DOI: 10.1039/c8cp05653f

2018-11

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Conformational dynamics of 1-phenyl-2,2,2-trifluoroethanol by rotational spectroscopy and ab initio calculations

Journal of molecular spectroscopy, 2018-09, Vol.351, p.62-67

2018

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Chirality Induction and Amplification in the 2,2,2-Trifluoroethanol⋅⋅⋅Propylene Oxide Adduct

Angewandte Chemie (International ed.), 2014-07, Vol.53 (28), p.7277-7280

2014

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Rotational Spectra of Two Hydrogen-Bonded Methyl Salicylate Monohydrates: Relative Stability and Tunneling Motions

The journal of physical chemistry letters, 2015-08, Vol.6 (16), p.3126-3131

2015

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Cover Feature: Competition Between Intra‐ and Intermolecular Hydrogen Bonding: o‐Anisic Acid⋅⋅⋅Formic Acid Heterodimer (Chem. Eur. J. 53/2019)

Chemistry : a European journal, 2019-09, Vol.25 (53), p.12230-12230

2019

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Tunnelling and barrier-less motions in the 2-fluoroethanol-water complex: a rotational spectroscopic and ab initio studyElectronic supplementary information (ESI) available: B3LYP-D3BJ calculated energies and constants of 2-FE H2O, relative energies of I, II, and the transition state of OH wagging, NCI and QTAIM plots of 2-FE, observed rotational transition frequencies, completion of ref. 30. See DOI: 10.1039/c7cp01666b

2017-05

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Conformational Landscape of m‑Anisic Acid and Its Complexes with Formic Acid

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2019-08, Vol.123 (31), p.6772-6780

2019

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Hydration of the simplest α-keto acid: a rotational spectroscopic and ab initio study of the pyruvic acid-water complex

Physical chemistry chemical physics : PCCP, 2017-02, Vol.19 (6), p.4440-4446

2017

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Chirped-Pulse and Cavity-Based Fourier Transform Microwave Spectra of the Methyl Lactate⋅⋅⋅Ammonia Adduct

Angewandte Chemie (International ed.), 2013-04, Vol.52 (16), p.4402-4405

2013

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

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

Competition Between Intra‐ and Intermolecular Hydrogen Bonding: o‐Anisic Acid⋅⋅⋅Formic Acid Heterodimer

IR, Raman, and Vibrational Optical Activity Spectra of Methyl Glycidate in Chloroform and Water: The Clusters‐in‐a‐liquid Solvation Model

Unusual H-Bond Topology and Bifurcated H-bonds in the 2-Fluoroethanol Trimer

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

Structure and tunneling dynamics in a model system of peptide co-solvents: rotational spectroscopy of the 2,2,2-trifluoroethanol⋯water complex

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

Structural and dynamical features of the 2,2,2-trifluoroethanol ammonia complex

Direct Spectroscopic Detection of the Orientation of Free OH Groups in Methyl Lactate-(Water)1,2 Clusters: Hydration of a Chiral Hydroxy Ester

Rotational spectra of two six-membered heterocyclic N-methyl-piperidinol compounds: Conformations by OH rotation, N-methyl inversion, and ring puckering

Rotational spectroscopy of the methyl glycidate-water complex: conformation and water and methyl rotor tunnelling motions

The Clusters-in-a-Liquid Approach for Solvation: New Insights from the Conformer Specific Gas Phase Spectroscopy and Vibrational Optical Activity Spectroscopy

Chirality Synchronization in Trifluoroethanol Dimer Revisited: The Missing Heterochiral Dimer

Tunnelling and barrier-less motions in the 2-fluoroethanol-water complex: a rotational spectroscopic and ab initio study

Thermomechanical responses of microfluidic cantilever capture DNA melting and properties of DNA premelting states using picoliters of DNA solution

Conformational dynamics of 1-phenyl-2,2,2-trifluoroethanol by rotational spectroscopy and ab initio calculations

Chirality Induction and Amplification in the 2,2,2-Trifluoroethanol⋅⋅⋅Propylene Oxide Adduct

Rotational Spectra of Two Hydrogen-Bonded Methyl Salicylate Monohydrates: Relative Stability and Tunneling Motions

Cover Feature: Competition Between Intra‐ and Intermolecular Hydrogen Bonding: o‐Anisic Acid⋅⋅⋅Formic Acid Heterodimer (Chem. Eur. J. 53/2019)

Conformational Landscape of m‑Anisic Acid and Its Complexes with Formic Acid

Hydration of the simplest α-keto acid: a rotational spectroscopic and ab initio study of the pyruvic acid-water complex

Chirped-Pulse and Cavity-Based Fourier Transform Microwave Spectra of the Methyl Lactate⋅⋅⋅Ammonia Adduct

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