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hal-03127909v1  Journal articles
Linjie ZhengSébastien ZamithMathias Rapacioli. Dynamical simulation of collision-induced dissociation of pyrene dimer cation
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, Springer Verlag, 2021, 140 (2), ⟨10.1007/s00214-020-02716-7⟩
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hal-02375800v1  Journal articles
Sébastien ZamithMingchao JiJean-Marc l'HermiteChristine JoblinLéo Dontot et al.  Thermal evaporation of pyrene clusters
Journal of Chemical Physics, American Institute of Physics, 2019, 151 (19), pp.194303. ⟨10.1063/1.5100264⟩
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hal-02915964v1  Journal articles
Sébastien ZamithJean-Marc l'HermiteLéo DontotLinjie ZhengMathias Rapacioli et al.  Threshold collision induced dissociation of pyrene cluster cations
Journal of Chemical Physics, American Institute of Physics, 2020, 153 (5), pp.054311. ⟨10.1063/5.0015385⟩
hal-00950358v1  Journal articles
Chia-Ying WuWei-Tzou LuhFlorent GadéaWilliam Stwalley. The D (1)Sigma(+) state of (7)LiH: Comparison of observations with vibronic theory
Journal of Chemical Physics, American Institute of Physics, 2008, 128 (6), pp.064303. ⟨10.1063/1.2827132⟩
hal-01082891v1  Journal articles
Michael WormitMałgorzata OlejniczakAnna-Lena DeppenmeierAnastasia BorschevskyTrond Saue et al.  Strong enhancement of parity violation effects in chiral uranium compounds.
Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2014, 16 (32), pp.17043-51. ⟨10.1039/c4cp01904k⟩
hal-01814771v1  Journal articles
Brandi WestRodriguez SarahAlicia SitSabria MohamadBethany Lowe et al.  Unimolecular reaction energies for polycyclic aromatic hydrocarbon ions
Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2018, 20 (10), pp.7195-7205. ⟨10.1039/C7CP07369K⟩
hal-00836824v1  Journal articles
Xuefeng WangLester AndrewsColin Marsden. Infrared Spectra and Density Functional Calculations of the SUO2 Molecule
Inorganic Chemistry, American Chemical Society, 2009, 48 (14), pp.6888-6895. ⟨10.1021/ic900869f⟩
hal-00971765v1  Journal articles
Xuefeng WangLester AndrewsColin Marsden. Infrared Spectrum and Structure of Thorimine (HN=ThH2)
Chemistry - A European Journal, Wiley-VCH Verlag, 2007, 13 (19), pp.5601-5606. ⟨10.1002/chem.200700183⟩
hal-00836863v1  Book sections
Pierre VitorgeBertrand SibouletColin MarsdenThomas Vercoute. The Use of Models to Understand the Aqueous Chemistry of Uranium
Gerhardt H. Wolfe. Uranium: Compounds, Isotopes and Applications, Nova publishers, pp.241-285, 2009, 978-1-60692-573-7
hal-01912209v1  Journal articles
Mickaël VerilPina RomanielloArjan BergerPierre-Francois Loos. Unphysical Discontinuities in GW Methods
Journal of Chemical Theory and Computation, American Chemical Society, 2018, 14 (10), pp.5220-5228. ⟨10.1021/acs.jctc.8b00745⟩
hal-00197119v1  Journal articles
J. VergnaudG. BouhadirD. BourissouLaure VendierMary Grellier et al.  Synthesis, structure and coordination of the ambiphilic ligand (2-picolyl) BCy2
Dalton Transactions, Royal Society of Chemistry, 2007, pp.2370-2372
hal-00872616v1  Journal articles
Marco VerdicchioStefano EvangelistiThierry LeiningerAntonio Monari. On the triplet ground state of tetrahedral X4 clusters (X = Li, Na, K, Cu).
Journal of Chemical Physics, American Institute of Physics, 2012, 136 (9), pp.094301-094307. ⟨10.1063/1.3687907⟩