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Simplification of Reaction Networks, Confluence and Elementary Modes
Guillaume Madelaine
,
Elisa Tonello
,
Cédric Lhoussaine
,
Joachim Niehren
Computation, 2017, Multiscale and Hybrid Modeling of the Living Systems
Journal articles
hal-01471074v1
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Regression Machine Learning Models Used to Predict DFT-Computed NMR Parameters of Zeolites
Robin Gaumard
,
Dominik Dragún
,
Jesús Pedroza-Montero
,
Bruno Alonso
,
Hazar Guesmi
et al.
Journal articles
hal-03669040v1
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Color Variability Constrains Detection of Geometrically Perfect Mirror Symmetry
Birgitta Dresp
Journal articles
hal-03702983v1
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Numerical Analysis of a Novel Twin-Impeller Centrifugal Compressor
van Thang Nguyen
,
Amélie Danlos
,
Florent Ravelet
,
Michael Deligant
,
Moises Solis
et al.
Journal articles
hal-03512226v1
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Evaluation of the Leak Detection Performance of Distributed Kalman Filter Algorithms in WSN-Based Water Pipeline Monitoring of Plastic Pipes
Valery Nkemeni
,
Fabien Mieyeville
,
Pierre Tsafack
Journal articles
hal-03670831v1
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Local Potential Functional Embedding Theory: A Self-Consistent Flavor of Density Functional Theory for Lattices without Density Functionals
Sajanthan Sekaran
,
Matthieu Saubanère
,
Emmanuel Fromager
Journal articles
hal-03833005v1
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Correlation between Computed Ion Hydration Properties and Experimental Values of Sugar Transfer through Nanofiltration and Ion Exchange Membranes in Presence of Electrolyte
Alessio Fuoco
,
Sylvain Galier
,
Hélène Roux De-Balmann
,
Giorgio de Luca
Journal articles
hal-01959201v1
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Metabolic Pathway Analysis in the Presence of Biological Constraints
Philippe Dague
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hal-03467719v1
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On Numerical Modeling of Thermal Performance Enhancementof a Heat Thermal Energy Storage System Using a Phase Change Material and a Porous Foam
Riheb Mabrouk
,
H. Naji
,
Hacen Dhahri
,
Zouhir Younsi
Journal articles
hal-03520975v1
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Solid-State Testing of a Van-Der-Waals-Corrected Exchange-Correlation Functional Based on the Semiclassical Atom Theory
Aleksandr V Terentjev
,
Pietro Cortona
,
Lucian A Constantin
,
José M M.Pitarke
,
Fabio Della Sala
et al.
Journal articles
hal-01769550v1
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Interaction of Hydrogen with Au Modified by Pd and Rh in View of Electrochemical Applications
Fernanda Juarez,
,
German Soldano,
,
Elizabeth Santos
,
Hazar Guesmi
,
Frederik Tielens
et al.
Journal articles
hal-01395929v1
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Periodic DFTB for Supported Clusters: Implementation and Application on Benzene Dimers Deposited on Graphene
Mathias Rapacioli
,
Nathalie Tarrat
Journal articles
hal-03681079v1
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On the Use of Benchmarks for Multiple Properties
Bartolomeo Civalleri
,
Roberto Dovesi
,
Pascal Pernot
,
Davide Presti
,
Andreas Savin
et al.
Journal articles
hal-01415837v1
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Should We Gain Confidence from the Similarity of Results between Methods?
Pascal Pernot
,
Andreas Savin
Journal articles
hal-03566402v1
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A Hybrid Computation Model to Describe the Progression of Multiple Myeloma and Its Intra-Clonal Heterogeneity
Anass Bouchnita
,
Fatima Ezzahra Belmaati
,
Rajae Aboulaich
,
M J K Koury
,
Vitaly A Volpert
et al.
Journal articles
hal-01565940v1
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Influence of the Chemical Pressure on the Magnetic Properties of the Mixed Anion Cuprates Cu2OX2 (X = Cl, Br, I)
W. Lafargue-Dit-Hauret
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X. Rocquefelte
Journal articles
hal-03691412v1
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DFT Study of Si/Al Ratio and Confinement Effects on the Energetics and Vibrational Properties of some Aza-Aromatic Molecules Adsorbed on H-ZSM-5 Zeolite
Martine Castellà-Ventura
,
Alain Moissette
,
Emile Kassab
Journal articles
hal-03079800v1
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Exact Boolean Abstraction of Linear Equation Systems
Emilie Allart
,
Joachim Niehren
,
Cristian Versari
Computation, 2021, 9 (11), pp.32
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hal-03384058v2
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On the High-Resolution Discretization of the Maxwell Equations in a Composite Tape and the Heating Effects Induced by the Dielectric Losses
Chady Ghnatios
,
Anaïs Barasinski
,
Francisco Chinesta
Journal articles
hal-03561110v1
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Dynamic Stability Enhancement of a Hybrid Renewable Energy System in Stand-Alone Applications
Ezzeddine Touti
,
Hossem Zayed
,
Remus Pusca
,
Raphael Romary
Journal articles
hal-03673200v1
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First Principle Modelling of Materials and Processes in Dye-Sensitized Photoanodes for Solar Energy and Solar Fuels
Mariachiara Pastore
Journal articles
hal-02395166v1
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Towards a Multiscale Model of Acute HIV Infection
Anass Bouchnita
,
Gennady Bocharov
,
Andreas Meyerhans
,
Vitaly Volpert
Journal articles
hal-01570577v1
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New Design and Optimization of a Jet Pump to Boost Heavy Oil Production
Jens Toteff
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Miguel Asuaje
,
Ricardo Noguera
Journal articles
hal-03611931v1
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Multiscale Modeling of the Early CD8 T-Cell Immune Response in Lymph Nodes: An Integrative Study
Sotiris Prokopiou
,
Loic Barbarroux
,
Samuel Bernard
,
Julien Mafille
,
Yann Leverrier
et al.
Journal articles
hal-01074736v1
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Non-Intrusive In-Plane-Out-of-Plane Separated Representation in 3D Parametric Elastodynamics
Claudia Germoso
,
Giacomo Quaranta
,
Jean Louis Duval
,
Francisco Chinesta
Journal articles
hal-02958659v1
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