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List of works by Jérôme Cuny

Aqueous solutions: state of the art in ab initio molecular dynamics.

scientific article published on 10 February 2014

Density-functional tight-binding: basic concepts and applications to molecules and clusters

scientific article published on 18 February 2020

Electric field gradient calculations in paramagnetic compounds using the PAW approach. Application to 23Na NMR in layered vanadium phosphates ⬇️

scientific article published on 05 September 2010

Evaluation of Gas-to-Liquid 17O Chemical Shift of Water: A Test Case for Molecular and Periodic Approaches

scientific article published on 06 August 2018

Keto-polymethines: a versatile class of dyes with outstanding spectroscopic properties for in cellulo and in vivo two-photon microscopy imaging.

scientific article published on 3 August 2016

Metal Atom Clusters as Building Blocks for Multifunctional Proton-Conducting Materials: Theoretical and Experimental Characterization

scientific article published on 30 July 2018

Molecular Dynamics Study of the Collision-Induced Reaction of H with CO on Small Water Clusters.

scientific article

Nuclear quantum effects and hydrogen bond fluctuations in water

scientific article published on 06 September 2013

Proton transfer through the water gossamer.

scientific article published on 18 July 2013

Size-dependent proton localization in hydrated uracil clusters: A joint experimental and theoretical study

scientific article published on 01 January 2019

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