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V

Valérie Vallet

CNRS and University of Lille

33H指数
358论文数
3.9K被引数
收录论文 60
发表时间
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Synthesis and Vibrational Identification of the Uranyl Peroxodicarbonato [UO2(O2)(CO3)2]4–: Insights into Peroxide-Carbonate Bonding from 18O Labeling; DFT; and QTAIM Analysis铀酰过氧碳酸根 [UO2(O2)(CO3)2]4– 的合成与振动识别：基于 18O 标记、DFT 和 QTAIM 分析的过氧化物-碳酸根键合研究
errInorganic Chemistry
IF4.7
err2026-05-26
err0
PREAI
errJulien Margate; Leonard Floarea; Charles Coubronne; Elise Berrier; Gaëlle Milanole; Florent Réal; Murielle Rivenet; Valérie Vallet
err分享
err收藏
Unveiling the Stability and Kinetic Pathway from Plutonium Clusters to Colloidal PuO2 Nanoparticles揭示从钚团簇到胶体PuO2纳米颗粒的稳定性和动力学路径
errInorganic Chemistry
IF4.7
err2026-04-01
err0
PREAI
errMaëva Munoz; Christelle Tamain; Matthieu Virot; Simon Bayle; Sandrine Dourdain; Thomas Dumas; Pier Lorenzo Solari; Denis Menut; Valérie Vallet; Dominique Guillaumont
err分享
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Environmental Effects via Frozen Density Embedding in Real-Time Time-Dependent Dirac–Kohn–Sham Theory: Solvation of Lead Halides通过冻结密度嵌入在实时含时Dirac–Kohn–Sham理论中的环境效应：卤化铅的溶剂化
errJournal of Chemical Theory and Computation
IF5.5
err2026-02-23
err0
errOAAI
errMatteo De Santis; Edoardo Mosconi; Leonardo Pacifici; Valérie Vallet; André Severo Pereira Gomes; Loriano Storchi; Leonardo Belpassi
err分享
err收藏
Inside Front Cover: Persistent Mono-Oxo Bonding with Protactinium(V) Revealed in Highly Acidic Chloride Solutions封二：在强酸性氯化物溶液中揭示的镤(V)持久单氧键合
errAngewandte Chemie International Edition
IF16.9
err2026-02-15
err0
errOAAI
errDr. Melody Maloubier; Tamara Shaaban; Dr. Florent Réal; Dr. Claire Le Naour; Dr. Hanna Oher; Titouan Aubert; Dr. Pier Lorenzo; Dr. Bruno Siberchicot; Dr. Rémi Maurice; Dr. Valérie Vallet
err分享
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Persistent Mono-Oxo Bonding with Protactinium(V) Revealed in Highly Acidic Chloride Solutions在高度酸性的氯化物溶液中揭示了与pro (V) 的持久单氧键合
errAngewandte Chemie International Edition
IF16.9
err2025-12-13
err0
errOAAI
errDr. Melody Maloubier; Tamara Shaaban; Dr. Florent Réal; Dr. Claire Le Naour; Dr. Hanna Oher; Titouan Aubert; Dr. Pier Lorenzo Solari; Dr. Bruno Siberchicot; Dr. Rémi Maurice; Dr. Valérie Vallet
err分享
err收藏
Core-Excited States of Linear and Bent Uranyl Complexes: Insights from High-Energy Resolution X-ray Spectroscopy and Relativistic Quantum Chemistry
errINORGANIC CHEMISTRY
IF4.7
err2025-10-01
err0
PREAI
errMisael, Wilken Aldair; Amidani, Lucia; Marz, Juliane; Bazarkina, Elena F.; Kvashnina, Kristina O.; Vallet, Valerie; Gomes, Andre Severo Pereira
err分享
err收藏
U4+ Speciation in Acidic Aqueous Solution: Insights from UV–Vis; EXAFS; XANES; and Quantum-Statistical Simulations酸性水溶液中U4+的形态：来自UV–Vis、EXAFS、XANES和量子-统计模拟的见解
errInorganic Chemistry
IF4.7
err2025-06-16
err0
PREAI
errGema Raposo-Hernández; Rafael R. Pappalardo; Florent Réal; Valérie Vallet; Enrique Sánchez Marcos
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Toward a realistic theoretical electronic spectra of metal aqua ions in solution: The case of Ce(H2O)n3+ using statistical methods and quantum chemistry calculations
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-10-10
err0
PREAI
errRaposo-Hernandez, Gema; Pappalardo, Rafael R.; Real, Florent; Vallet, Valerie; Marcos, Enrique Sanchez
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Experimental and Theoretical Study of the Reaction of F2 with Thiirane
errMOLECULES
IF4.6
err2024-07-31
err0
errOAAI
errBedjanian, Yuri; Roose, Antoine; Vallet, Valerie; Romanias, Manolis N.
err分享
err收藏
Interoperable workflows by exchanging grid-based data between quantum-chemical program packages
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-04-30
err3
errOAAI
errFocke, Kevin; De Santis, Matteo; Wolter, Mario; Martinez, Jessica A. B.; Vallet, Valerie; Pereira Gomes, Andre Severo; Olejniczak, Malgorzata; Jacob, Christoph R.
err分享
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Stability of the protactinium(V) mono-oxo cation probed by first-principle calculations
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2024-02-21
err1
errOAAI
errShaaban, Tamara; Real, Florent; Maurice, Remi; Vallet, Valerie
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How Does Bending the Uranyl Unit Influence Its Spectroscopy and Luminescence?
errINORGANIC CHEMISTRY
IF4.7
err2023-06-06
err8
errOAAI
errOher, Hanna; Gomes, Andre SeveroPereira; Wilson, Richard E.; Schnaars, David D.; Vallet, Valerie
err分享
err收藏
Protein-ligand interactions from a quantum fragmentation perspective: The case of the SARS-CoV-2 main protease interacting with α-ketoamide inhibitors
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-06-05
err2
errOAAI
errGenovese, Luigi; Dawson, William; Nakajima, Takahito; Cristiglio, Viviana; Vallet, Valerie; Masella, Michel
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Structural and thermodynamics properties of pure phase alkanes, monoamides and alkane/monoamide mixtures with an ab initio based force-field model
errJOURNAL OF MOLECULAR LIQUIDS
IF5.2
err2022-10-01
err1
errOAAI
errFailali, Abdelmounaim; Acher, Eleonor; Guillaumont, Dominique; Vallet, Valerie; Real, Florent
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Frozen-Density Embedding for Including Environmental Effects in the Dirac-Kohn-Sham Theory: An Implementation Based on Density Fitting and Prototyping Techniques
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-09-29
err4
errOAAI
errDe Santis, Matteo; Sorbelli, Diego; Vallet, Valerie; Gomes, Andre Severo Pereira; Storchi, Loriano; Belpassi, Leonardo
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Environment Effects on X-Ray Absorption Spectra With Quantum Embedded Real-Time Time-Dependent Density Functional Theory Approaches量子嵌入实时时间相关密度泛函理论方法对x射线吸收谱的环境影响
errFRONTIERS IN CHEMISTRY
IF4.2
err2022-02-28
err3
errOAAI
errDe Santis, Matteo; Vallet, Valerie; Gomes, Andre Severo Pereira
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Hexanitrato complexes and hybrid double perovskites of Am3+ and Cm3+
errCHEMICAL COMMUNICATIONS
IF4.2
err2022-01-01
err4
errOAAI
errTarlton, Michael L.; Skanthakumar, Suntharalingam; Vallet, Valerie; Wilson, Richard E.
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Uranium(IV) alkyl cations: synthesis, structures, comparison with thorium(IV) analogues, and the influence of arene-coordination on thermal stability and ethylene polymerization activity
errCHEMICAL SCIENCE
IF7.4
err2022-01-01
err8
errOAAI
errAndreychuk, Nicholas R.; Vidjayacoumar, Balamurugan; Price, Jeffrey S.; Kervazo, Sophie; Peeples, Craig A.; Emslie, David J. H.; Vallet, Valerie; Gomes, Andre S. P.; Real, Florent; Schreckenbach, Georg; Ayers, Paul W.; Vargas-Baca, Ignacio; Jenkins, Hilary A.; Britten, James F.
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Influence of the First Coordination of Uranyl on Its Luminescence Properties: A Study of Uranyl Binitrate with N,N-Dialkyl Amide DEHiBA and Water
errINORGANIC CHEMISTRY
IF4.7
err2021-12-09
err11
errOAAI
errOher, Hanna; Ferru, Geoffroy; Couston, Laurent; Berthon, Laurence; Guillaumont, Dominique; Real, Florent; Vercouter, Thomas; Vallet, Valerie
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Revisiting the Complexation of Cm(III) with Aqueous Phosphates: What Can We Learn from the Complex Structures Using Luminescence Spectroscopy and Ab Initio Simulations?
errINORGANIC CHEMISTRY
IF4.7
err2021-06-30
err4
errOAAI
errHuittinen, Nina; Jessat, Isabelle; Real, Florent; Vallet, Valerie; Starke, Sebastian; Eibl, Manuel; Jordan, Norbert
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研究方向

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合作学者
合作期刊
W
Wolfgang Domcke
H 指数: 91 · 论文数: 525
P
Paul W. Ayers
H 指数: 76 · 论文数: 518
C
Christel M. Marian
H 指数: 57 · 论文数: 344
R
Richard E. Wilson
H 指数: 54 · 论文数: 632
U
Ulf Wahlgren
H 指数: 51 · 论文数: 225
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