publications_temp

2371 documents

  • Philippe C. Hiberty, Sason Shaik. Understanding Valence Bond Theory. Comprehensive Computational Chemistry, Elsevier, pp.255-275, 2024, ⟨10.1016/B978-0-12-821978-2.00014-3⟩. ⟨hal-04310591⟩
  • Sason Shaik, David Danovich, Jyothish Joy, Philippe C. Hiberty. Valence Bond Diagrams and Chemical Reactivity. Comprehensive Computational Chemistry, Elsevier, pp.683-711, 2024, ⟨10.1016/B978-0-12-821978-2.00002-7⟩. ⟨hal-04310585⟩
  • Sason Shaik, Philippe C. Hiberty. Introduction to the Valence Bond Section of the Mrw Project. Comprehensive Computational Chemistry, Elsevier, pp.252-254, 2024, ⟨10.1016/B978-0-12-821978-2.00063-5⟩. ⟨hal-04310601⟩
  • Slavko Radenković, Dominik Domin, Julien Toulouse, Benoît Braïda. The Valence-Bond Quantum Monte Carlo Method. Manuel Yáñez; Russell J. Boyd. Comprehensive Computational Chemistry, 1, Elsevier, pp.331-353, 2024, 978-0-12-823256-9. ⟨10.1016/B978-0-12-821978-2.00033-7⟩. ⟨hal-04284193⟩
  • Brieuc Le Dé, Amine Jaouadi, Etienne Mangaud, Alex W Chin, Michèle Desouter-Lecomte. Managing temperature in open quantum systems strongly coupled with structured environments. The Journal of Chemical Physics, 2024, 160 (24), pp.244102. ⟨10.1063/5.0214051⟩. ⟨hal-04634337⟩
  • Vincent Richardson, Miroslav Polášek, Claire Romanzin, Paolo Tosi, Roland Thissen, et al.. Reactivity of the Ethenium Cation (C2H5+) with Ethyne (C2H2): A Combined Experimental and Theoretical Study. Molecules, 2024, 29 (4), pp.810. ⟨10.3390/molecules29040810⟩. ⟨hal-04455989⟩
  • Apakorn Phasuk, Joël Lemaire, Vincent Steinmetz, Philippe Maître, Ricardo Metz. How the nature and charge of metal cations affect vibrations in acetone solvent molecules. Physical Chemistry Chemical Physics, 2024, 26 (4), pp.3101-3109. ⟨10.1039/d3cp05204d⟩. ⟨hal-04681181⟩
  • Yassine Naciri, Mohamed Nawfal Ghazzal, Erwan Paineau. Nanosized tubular clay minerals as inorganic nanoreactors for energy and environmental applications: A review to fill current knowledge gaps. Advances in Colloid and Interface Science, 2024, 326, pp.103139. ⟨10.1016/j.cis.2024.103139⟩. ⟨hal-04525942⟩
  • Pablo Jiménez-Calvo, Yassine Naciri, Anna Sobolewska, Mark Isaacs, Yu Zhang, et al.. Ti‐Modified Imogolite Nanotubes as Promising Photocatalyst 1D Nanostructures for H 2 Production. Small Methods, 2024, pp.2301369. ⟨10.1002/smtd.202301369⟩. ⟨hal-04478104⟩
  • Ana Andrea Méndez-Medrano, Daniel Bahena-Uribe, Diana Dragoe, Carine Clavaguéra, Christophe Colbeau-Justin, et al.. Enhanced Photocatalytic Activity of Surface-Modified TiO2 with Bimetallic AuPd Nanoalloys for Hydrogen Generation. Solar RRL, 2024, 8 (13), pp.2400106. ⟨10.1002/solr.202400106⟩. ⟨hal-04679858⟩

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