Discovering the elusive global minimum in a ternary chiral cluster: Rotational spectra of propylene oxide trimer F Xie, M Fusè, AS Hazrah, W Jäger, V Barone, Y Xu Angewandte Chemie 132 (50), 22613-22616, 2020 | 58 | 2020 |
The rich conformational landscape of perillyl alcohol revealed by broadband rotational spectroscopy and theoretical modelling F Xie, NA Seifert, M Heger, J Thomas, W Jäger, Y Xu Physical Chemistry Chemical Physics 21 (28), 15408-15416, 2019 | 54 | 2019 |
Conformational panorama and chirality controlled structure–energy relationship in a chiral carboxylic acid dimer F Xie, NA Seifert, W Jäger, Y Xu Angewandte Chemie International Edition 59 (36), 15703-15710, 2020 | 47 | 2020 |
Conformational dynamics of 1-phenyl-2, 2, 2-trifluoroethanol by rotational spectroscopy and ab initio calculations CD Carlson, NA Seifert, M Heger, F Xie, J Thomas, Y Xu Journal of Molecular Spectroscopy 351, 62-67, 2018 | 36 | 2018 |
Rotational spectroscopy of chiral tetrahydro-2-furoic acid: Conformational landscape, conversion, and abundances F Xie, X Ng, NA Seifert, J Thomas, W Jäger, Y Xu The Journal of Chemical Physics 149 (22), 2018 | 29 | 2018 |
Rotational spectroscopy of the methyl glycidate–water complex: conformation and water and methyl rotor tunnelling motions JTA Gall, J Thomas, F Xie, Z Wang, W Jäger, Y Xu Physical Chemistry Chemical Physics 19 (43), 29508-29515, 2017 | 24 | 2017 |
Tunable H2 binding on alkaline and alkaline earth metals decorated graphene substrates from first-principles calculations Y Wen, F Xie, X Liu, X Liu, R Chen, K Cho, B Shan international journal of hydrogen energy 42 (15), 10064-10071, 2017 | 18 | 2017 |
Conformational Landscape, Chirality Recognition and Chiral Analyses: Rotational Spectroscopy of Tetrahydro‐2‐Furoic Acid⋅⋅⋅ Propylene Oxide Conformers F Xie, NA Seifert, AS Hazrah, W Jäger, Y Xu ChemPhysChem 22 (5), 455-460, 2021 | 16 | 2021 |
A spectroscopic and ab initio study of the hydrogen peroxide–formic acid complex: hindering the internal motion of H 2 O 2 LY Li, NA Seifert, F Xie, M Heger, Y Xu, W Jäger Physical Chemistry Chemical Physics 20 (33), 21345-21351, 2018 | 11 | 2018 |
Modifying conformational distribution of chiral tetrahydro-2-furoic acid through its interaction with water: a rotational spectroscopic and theoretical investigation F Xie, S Mahendiran, NA Seifert, Y Xu Physical Chemistry Chemical Physics 23 (6), 3820-3825, 2021 | 10 | 2021 |
The pyrrole-water complex: Multidimensional large amplitude dynamics and rotational spectra of its 13C isotopologues B Wu, F Xie, Y Xu Journal of Molecular Spectroscopy 374, 111381, 2020 | 8 | 2020 |
CO2 Aggregation on Monoethanolamine: Observations from Rotational Spectroscopy F Xie, W Sun, P Pinacho, M Schnell Angewandte Chemie 135 (14), e202218539, 2023 | 6 | 2023 |
Microwave spectrum of the complex of 3, 3, 3-trifluoro-2-(trifluoromethyl) propanoic acid and formic acid J Thomas, MJ Carrillo, A Serrato III, F Xie, W Jäger, Y Xu, W Lin Molecular Physics 117 (9-12), 1193-1199, 2019 | 6 | 2019 |
Conformational landscape and intricate conformational relaxation paths of 4, 4, 4-trifluoro-1-butanol: Rotational spectroscopy and quantum chemical calculations T Lu, F Xie, NA Seifert, W Jäger, Y Xu Journal of Molecular Structure 1217, 128359, 2020 | 5 | 2020 |
Structural and energetic properties of protonated and sodiated asparagine probed by a new laboratory IRMPD spectrometer M Heger, J Cheramy, F Xie, Z Chen, Y Xu Journal of Molecular Spectroscopy 352, 36-44, 2018 | 4 | 2018 |
Rotational Spectroscopy of 2‐Furoic Acid and Its Dimer: Conformational Distribution and Double Proton Tunneling A Insausti, J Ma, Q Yang, F Xie, Y Xu ChemPhysChem 23 (12), e202200176, 2022 | 3 | 2022 |
Hydrogen bonding interactions in the 1, 1, 1, 3, 3, 3-hexafluoro-2-propanol∙∙∙ 1, 4-dioxane complex: Rotational spectroscopy and density functional theory calculations Q Yang, F Xie, T Lu, N Bui, W Jäger, Y Xu Journal of Molecular Spectroscopy 376, 111408, 2021 | 3 | 2021 |
Electric nuclear quadrupole coupling reveals dissociation of HCl with a few water molecules F Xie, DS Tikhonov, M Schnell Science, eado7049, 2024 | 1 | 2024 |
Hydrogen‐Atom Tunneling in a Homochiral Environment F Xie, W Sun, B Hartwig, DA Obenchain, M Schnell Angewandte Chemie International Edition 62 (37), e202308273, 2023 | 1 | 2023 |
Chiral Analysis Using Molecular Rotational Resonance Spectroscopy F Xie | | 2021 |