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Julien Toulouse

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A density-fitting implementation of the density-based basis-set correction method

Andreas Hesselmann , Emmanuel Giner , Peter Reinhardt , Peter Knowles , Hans-Joachim Werner
Journal of Computational Chemistry, In press, ⟨10.1002/jcc.27325⟩
Journal articles hal-04210752v2
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Semiclassical approximations of photoabsorption cross sections beyond the continuum threshold

Julien Toulouse
European Physical Journal A, 2023, Topical Collection devoted to the legacy of Peter Schuck, 59 (98), ⟨10.1140/epja/s10050-023-01015-6⟩
Journal articles hal-04078106v1
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Effective quantum electrodynamics: One-dimensional model of the relativistic hydrogen-like atom

Timothée Audinet , Julien Toulouse
Journal of Chemical Physics, 2023, 158, pp.244108. ⟨10.1063/5.0152956⟩
Journal articles hal-04102685v2
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Basis-set correction based on density-functional theory: Linear-response formalism for excited-state energies

Diata Traore , Emmanuel Giner , Julien Toulouse
Journal of Chemical Physics, 2023, 158, pp.234107. ⟨10.1063/5.0156317⟩
Journal articles hal-04107625v1
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Basis-set correction based on density-functional theory: Rigorous framework for a one-dimensional model

Diata Traore , Emmanuel Giner , Julien Toulouse
Journal of Chemical Physics, 2022, 156, pp.044113. ⟨10.1063/5.0076128⟩
Journal articles hal-03391682v3
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Self-consistent density-based basis-set correction: How much do we lower total energies and improve dipole moments?

Emmanuel Giner , Diata Traore , Barthélemy Pradines , Julien Toulouse
Journal of Chemical Physics, 2022, 155, pp.044109
Journal articles hal-03234580v1
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Systematic lowering of the scaling of Monte Carlo calculations by partitioning and subsampling

Antoine Bienvenu , Jonas Feldt , Julien Toulouse , Roland Assaraf
Physical Review E , 2022, 106, pp.025301
Journal articles hal-03656059v2
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Basis-set correction for coupled-cluster estimation of dipole moments

Diata Traore , Julien Toulouse , Emmanuel Giner
Journal of Chemical Physics, 2022, 156 (17), ⟨10.1063/5.0087794⟩
Journal articles hal-03588392v2
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Photoionization and core resonances from range-separated time-dependent density-functional theory for open-shell states: Example of the lithium atom

Julien Toulouse , Karno Schwinn , Felipe Zapata , Antoine Levitt , Éric Cancès
Journal of Chemical Physics, 2022, 157 (24), pp.244104. ⟨10.1063/5.0134645⟩
Journal articles hal-03849878v1
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Photoionization and core resonances from range-separated density-functional theory: General formalism and example of the beryllium atom

Karno Schwinn , Felipe Zapata , Antoine Levitt , Eric Cancès , Eleonora Luppi
Journal of Chemical Physics, 2022, 156 (22), pp.224106. ⟨10.1063/5.0091073⟩
Journal articles hal-03605574v2
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Accurate energies of transition metal atoms, ions, and monoxides using selected configuration interaction and density-based basis-set corrections

Yuan Yao , Emmanuel Giner , Tyler Anderson , Julien Toulouse , C. Umrigar
Journal of Chemical Physics, 2021, 155 (20), pp.204104. ⟨10.1063/5.0072296⟩
Journal articles hal-03453822v1

Self-consistent density-based basis-set correction: How much do we lower total energies and improve dipole moments?

Emmanuel Giner , Diata Traore , Barthélemy Pradines , Julien Toulouse
Journal of Chemical Physics, 2021, 155 (4), pp.044109. ⟨10.1063/5.0057957⟩
Journal articles hal-03453816v1
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Short‐range correlation energy of the relativistic homogeneous electron gas

Julien Paquier , Julien Toulouse
International Journal of Quantum Chemistry, 2021, ⟨10.1002/qua.26685⟩
Journal articles hal-03234781v1
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Density-Based Basis-Set Incompleteness Correction for GW Methods

Pierre-François Loos , Barthélémy Pradines , Anthony Scemama , Emmanuel Giner , Julien Toulouse
Journal of Chemical Theory and Computation, 2020, 16 (2), pp.1018. ⟨10.1021/acs.jctc.9b01067⟩
Journal articles hal-02346969v1
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Almost exact energies for the Gaussian-2 set with the semistochastic heat-bath configuration interaction method

Yuan Yao , Emmanuel Giner , Junhao Li , Julien Toulouse , C. J Umrigar
Journal of Chemical Physics, 2020, 153 (12), pp.124117. ⟨10.1063/5.0018577⟩
Journal articles hal-02991165v1
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A basis-set error correction based on density-functional theory for strongly correlated molecular systems

Emmanuel Giner , Anthony Scemama , Pierre-François Loos , Julien Toulouse
Journal of Chemical Physics, 2020, 152, pp.174104. ⟨10.1063/5.0002892⟩
Journal articles hal-02458920v2
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Relativistic short-range exchange energy functionals beyond the local-density approximation

Julien Paquier , Emmanuel Giner , Julien Toulouse
Journal of Chemical Physics, inPress
Journal articles hal-02480263v2
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Self-consistent range-separated density-functional theory with second-order perturbative correction via the optimized-effective-potential method

Szymon Smiga , Ireneusz Grabowski , Mateusz Witkowski , Bastien Mussard , Julien Toulouse
Journal of Chemical Theory and Computation, inPress, ⟨10.1021/acs.jctc.9b00807⟩
Journal articles hal-02420461v1
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Quantum Package 2.0: An Open-Source Determinant-Driven Suite of Programs

Yann Garniron , Thomas Applencourt , Kevin Gasperich , Anouar Benali , Anthony Ferté
Journal of Chemical Theory and Computation, 2019, 15 (6), pp.3591-3609. ⟨10.1021/acs.jctc.9b00176⟩
Journal articles hal-02045595v1
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Range-separated double-hybrid density-functional theory with coupled-cluster and random-phase approximations

Cairedine Kalai , Bastien Mussard , Julien Toulouse
Journal of Chemical Physics, 2019, 151, pp.074102. ⟨10.1063/1.5108536⟩
Journal articles hal-02114946v2
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Chemically Accurate Excitation Energies With Small Basis Sets

Emmanuel Giner , Anthony Scemama , Julien Toulouse , Pierre-Francois Loos
Journal of Chemical Physics, 2019, 151 (14), pp.144118. ⟨10.1063/1.5122976⟩
Journal articles hal-02289341v2

A Density-Based Basis-Set Correction for Wave Function Theory

Pierre-François Loos , Barthélémy Pradines , Anthony Scemama , Julien Toulouse , Emmanuel Giner
Journal of Physical Chemistry Letters, 2019, 10 (11), pp.2931-2937. ⟨10.1021/acs.jpclett.9b01176⟩
Journal articles hal-02153216v1
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Linear-response range-separated density-functional theory for atomic photoexcitation and photoionization spectra

Felipe Zapata , Eleonora Luppi , Julien Toulouse
Journal of Chemical Physics, inPress, 150, pp.234104. ⟨10.1063/1.5096037⟩
Journal articles hal-02072512v2
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Range-separated multideterminant density-functional theory with a short-range correlation functional of the on-top pair density

Anthony Ferté , Emmanuel Giner , Julien Toulouse
Journal of Chemical Physics, inPress
Journal articles hal-01990358v1
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A formally exact one-frequency-only Bethe-Salpeter-like equation. Similarities and differences between GW +BSE and self-consistent RPA

Valerio Olevano , Julien Toulouse , Peter Schuck
Journal of Chemical Physics, 2019, 150 (8), pp.084112. ⟨10.1063/1.5080330⟩
Journal articles hal-01959688v2
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Asymptotic behavior of the Hartree-exchange and correlation potentials in ensemble density functional theory

Tim Gould , Stefano Pittalis , Julien Toulouse , Eli Kraisler , Leeor Kronik
Physical Chemistry Chemical Physics, 2019, 21 (36), pp.19805-19815. ⟨10.1039/c9cp03633d⟩
Journal articles hal-02332603v1
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Range-separated density-functional theory applied to the beryllium dimer and trimer

Peter Reinhardt , Julien Toulouse , Andreas Savin
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, In press
Journal articles hal-01879159v1
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Excitation energies from Görling-Levy perturbation theory along the range-separated adiabatic connection

Elisa Rebolini , Andrew M. Teale , Trygve Helgaker , Andreas Savin , Julien Toulouse
Molecular Physics, 2018, , pp.. ⟨10.1080/00268976.2017.1422811⟩
Journal articles hal-01643356v2
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A general range-separated double-hybrid density-functional theory

Cairedine Kalai , Julien Toulouse
Journal of Chemical Physics, inPress, 148, pp.164105
Journal articles hal-01761092v1
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Four-component relativistic range-separated density-functional theory: Short-range exchange local-density approximation

Julien Paquier , Julien Toulouse
Journal of Chemical Physics, 2018
Journal articles hal-01942323v1
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Multiconfigurational short-range density-functional theory for open-shell systems

Erik Donovan Hedegård , Julien Toulouse , Hans Jørgen Aa. Jensen
Journal of Chemical Physics, 2018, 148, pp.214103. ⟨10.1063/1.5013306⟩
Journal articles hal-01832349v1
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Curing basis-set convergence of wave-function theory using density-functional theory: a systematically improvable approach

Emmanuel Giner , Barthélémy Pradines , Anthony Ferté , Roland Assaraf , Andreas Savin
Journal of Chemical Physics, 2018, 149, pp.194301. ⟨10.1063/1.5052714⟩
Journal articles hal-01865504v1
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On the optimal basis set for electron dynamics in strong laser fields: The case of molecular ion H2+

Marie Labeye , Felipe Zapata , Emanuele Coccia , Valérie Véniard , Julien Toulouse
Journal of Chemical Theory and Computation, 2018, 14 (11), pp.5846-5858. ⟨10.1021/acs.jctc.8b00656⟩
Journal articles hal-02004937v1
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Time-dependent linear-response variational Monte Carlo

Bastien Mussard , Emanuele Coccia , Roland Assaraf , Matt Otten , C. J. Umrigar
Advances in Quantum Chemistry, 2017, Novel Electronic Structure Theory: General Innovations and Strongly Correlated Systems
Journal articles hal-01528081v1
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Casimir-Polder size consistency – a constraint violated by some dispersion theories

Tim Gould , Julien Toulouse , János Ángyán , John F. Dobson
Journal of Chemical Theory and Computation, 2017, 13, pp.5829. ⟨10.1021/acs.jctc.7b00996⟩
Journal articles hal-01644099v1
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Ab initio lifetime correction to scattering states for time-dependent electronic-structure calculations with incomplete basis sets

Emanuele Coccia , Roland Assaraf , Eleonora Luppi , Julien Toulouse
Journal of Chemical Physics, 2017, 147, pp.014106. ⟨10.1063/1.4991563⟩
Journal articles hal-01546677v1
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Fractional-charge and fractional-spin errors in range-separated density-functional theory

Bastien Mussard , Julien Toulouse
Molecular Physics, 2017, 115 (1-2), pp.161. ⟨10.1080/00268976.2016.1213910⟩
Journal articles hal-01344404v1
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Introduction to the variational and diffusion Monte Carlo methods

Julien Toulouse , Roland Assaraf , C. J. Umrigar
Advances in Quantum Chemistry, 2016, Electron Correlation in Molecules – ab initio Beyond Gaussian Quantum Chemistry, 73, pp.285. ⟨10.1016/bs.aiq.2015.07.003⟩
Journal articles hal-01183633v1
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Gaussian continuum basis functions for calculating high-harmonic generation spectra

Emanuele Coccia , Bastien Mussard , Marie Labeye , Jérémie Caillat , Richard Taïeb
International Journal of Quantum Chemistry, 2016, 116, pp.1120. ⟨10.1002/qua.25146⟩
Journal articles hal-01277883v2
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Quantum Monte Carlo with reoptimised perturbatively selected configuration-interaction wave functions

Emmanuel Giner , Roland Assaraf , Julien Toulouse
Molecular Physics, 2016, 114, pp.910. ⟨10.1080/00268976.2016.1149630⟩
Journal articles hal-01260326v1
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Blind test of density-functional-based methods on intermolecular interaction energies

Decarlos Taylor , János Ángyán , Giulia Galli , Cui Zhang , Francois Gygi
Journal of Chemical Physics, 2016, 145 (12), pp.124105. ⟨10.1063/1.4961095⟩
Journal articles hal-03958068v1
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Range-separated time-dependent density-functional theory with a frequency-dependent second-order Bethe-Salpeter correlation kernel

Elisa Rebolini , Julien Toulouse
Journal of Chemical Physics, 2016, 144, pp.094107. ⟨10.1063/1.4943003⟩
Journal articles hal-01184145v3
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Self-consistent double-hybrid density-functional theory using the optimized-effective-potential method

Szymon Smiga , Odile Franck , Bastien Mussard , Adam Buksztel , Ireneusz Grabowski
Journal of Chemical Physics, 2016, 145, pp.144102. ⟨10.1063/1.4964319⟩
Journal articles hal-01346158v2
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Range-separated double-hybrid density-functional theory applied to periodic systems

Giuseppe Sansone , Bartolomeo Civalleri , Denis Usvyat , Julien Toulouse , Kamal Sharkas
Journal of Chemical Physics, 2015, 143, pp.102811. ⟨10.1063/1.4922996⟩
Journal articles hal-01165841v1
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Excited states from range-separated density-functional perturbation theory

Elisa Rebolini , Julien Toulouse , Andrew M. Teale , Trygve Helgaker , Andreas Savin
Molecular Physics, 2015, 113, pp.1740. ⟨10.1080/00268976.2015.1011248⟩
Journal articles hal-01094169v1
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Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights.

Bastien Mussard , Peter Reinhardt , Janos Angyan , Julien Toulouse
Journal of Chemical Physics, 2015, pp.00. ⟨10.1063/1.4918710⟩
Journal articles hal-01141968v2
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Calculating excitation energies by extrapolation along adiabatic connections

Elisa Rebolini , Julien Toulouse , Andrew M. Teale , Trygve Helgaker , Andreas Savin
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2015, 91, pp.032519. ⟨10.1103/PhysRevA.91.032519⟩
Journal articles hal-01133338v1
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Basis convergence of range-separated density-functional theory

Odile Franck , Bastien Mussard , Eleonora Luppi , Julien Toulouse
Journal of Chemical Physics, 2015, 142, pp.074107. ⟨10.1063/1.4907920⟩
Journal articles hal-01081816v2

Kohn-Sham potentials in exact density-functional theory at noninteger electron numbers

Tim Gould , Julien Toulouse
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2014, 90, pp.050502(R). ⟨10.1103/PhysRevA.90.050502⟩
Journal articles hal-01081808v1
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Double-hybrid density-functional theory applied to molecular crystals

Kamal Sharkas , Julien Toulouse , Lorenzo Maschio , Bartolomeo Civalleri
Journal of Chemical Physics, 2014, 141, pp.044105. ⟨10.1063/1.4890439⟩
Journal articles hal-01018205v1
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Double-hybrid density-functional theory with meta-generalized-gradient approximations

Sidi Ould Souvi , Kamal Sharkas , Julien Toulouse
Journal of Chemical Physics, 2014, 140, pp.084107. ⟨10.1063/1.4865963⟩
Journal articles hal-00920176v2
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Relever le défi de la résolution de l'équation de Schrödinger

Thierry Leininger , Julien Toulouse
L'Actualité Chimique, 2014, 382-383, pp.13-21
Journal articles hal-00927103v1
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Excitation energies along a range-separated adiabatic connection

Elisa Rebolini , Julien Toulouse , Andrew M. Teale , Trygve Helgaker , Andreas Savin
Journal of Chemical Physics, 2014, 141, pp.044123. ⟨10.1063/1.4890652⟩
Journal articles hal-00985367v2
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Assessment of range-separated time-dependent density-functional theory for calculating C6 dispersion coefficients

Julien Toulouse , Elisa Rebolini , Tim Gould , John F. Dobson , Prasenjit Seal
Journal of Chemical Physics, 2013, 138, pp.194106. ⟨10.1063/1.4804981⟩
Journal articles hal-00819369v2
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Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory

Alexandrina Stoyanova , Andrew M. Teale , Julien Toulouse , Trygve Helgaker , Emmanuel Fromager
Journal of Chemical Physics, 2013, 139, pp.134113
Journal articles hal-00967719v1
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Electronic excitations from a linear- response range-separated hybrid scheme

Elisa Rebolini , Andreas Savin , Julien Toulouse
Molecular Physics, 2013, 111 (9-11), pp.10.1080/00268976.2013.794313
Journal articles hal-00808223v1
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Approaching chemical accuracy with quantum Monte Carlo

Frank R. Petruzielo , Julien Toulouse , C. J. Umrigar
Journal of Chemical Physics, 2012, 136, pp.124116. ⟨10.1063/1.3697846⟩
Journal articles hal-00974223v1
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A multiconfigurational hybrid density-functional theory

Kamal Sharkas , Andreas Savin , Hans Jørgen Aa. Jensen , Julien Toulouse
Journal of Chemical Physics, 2012, 137 (4), pp.044104. ⟨10.1063/1.4733672⟩
Journal articles hal-00724033v1
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Rationale for a new class of double-hybrid approximations in density-functional theory

Julien Toulouse , Kamal Sharkas , Eric Brémond , Carlo Adamo
Journal of Chemical Physics, 2011, 135 (10), pp.101102. ⟨10.1063/1.3640019⟩
Journal articles hal-00618140v1
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Correlation energy expressions from the adiabatic-connection fluctuation-dissipation theorem approach

János G. Angyán , Ru-Fen Liu , Julien Toulouse , Georg Jansen
Journal of Chemical Theory and Computation, 2011, 7, pp.3116. ⟨10.1021/ct200501r⟩
Journal articles hal-00967703v1
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Basis set construction for molecular electronic structure theory: Natural orbital and Gauss-Slater basis for smooth pseudopotentials

Frank R. Petruzielo , Julien Toulouse , C. J. Umrigar
Journal of Chemical Physics, 2011, 134, pp.064104. ⟨10.1063/1.3551512⟩
Journal articles hal-00974320v1
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Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions

Julien Toulouse , Wuming Zhu , Andreas Savin , Georg Jansen , János G. Angyán
Journal of Chemical Physics, 2011, 135 (8), pp.084119. ⟨10.1063/1.3626551⟩
Journal articles hal-00612814v2
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Quantum Monte Carlo with Jastrow-valence-bond wave functions

Benoît Braïda , Julien Toulouse , Michel Caffarel , C. J. Umrigar
Journal of Chemical Physics, 2011, 134 (8), pp.084108. ⟨10.1063/1.3555821⟩
Journal articles hal-00553700v2
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Double-hybrid density-functional theory made rigorous

Kamal Sharkas , Julien Toulouse , Andreas Savin
Journal of Chemical Physics, 2011, 134 (6), pp.064113. ⟨10.1063/1.3544215⟩
Journal articles hal-00550562v2
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Compact and flexible basis functions for quantum Monte Carlo calculations

Frank R. Petruzielo , Julien Toulouse , C. J. Umrigar
Journal of Chemical Physics, 2010, 132, pp.094109. ⟨10.1063/1.334206⟩
Journal articles hal-00978167v1
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About the collapse of the 3.3 μm CH stretching band with ionization in polycyclic aromatic hydrocarbons: Configuration interaction and quantum Monte Carlo studies of the CH fragment

Françoise Pauzat , Julien Pilmé , Julien Toulouse , Yves Ellinger
Journal of Chemical Physics, 2010, 133 (5), pp.054301. ⟨10.1063/1.3465552⟩
Journal articles hal-03740042v1
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Combining density-functional theory and density-matrix-functional theory

Daniel R. Rohr , Julien Toulouse , Katarzyna Pernal
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2010, 82, pp.052502. ⟨10.1103/PhysRevA.82.052502⟩
Journal articles hal-00974324v1
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Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions

Wuming Zhu , Julien Toulouse , Andreas Savin , János G. Angyán
Journal of Chemical Physics, 2010, 132, pp.244108. ⟨10.1063/1.3431616⟩
Journal articles hal-00976481v1
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Range-separated density-functional theory with the random-phase approximation: Detailed formalism and illustrative applications

Julien Toulouse , Wuming Zhu , János G. Angyán , Andreas Savin
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2010, 82, pp.032502. ⟨10.1103/PhysRevA.82.032502⟩
Journal articles hal-00975110v1
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Excited states of methylene from quantum Monte Carlo

Paul Zimmerman , Julien Toulouse , Zhiyong Zhang , Charles Musgrave , C. Umrigar
Journal of Chemical Physics, 2009, 131 (12), pp.124103. ⟨10.1063/1.3220671⟩
Journal articles hal-03740048v1
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Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation

Julien Toulouse , I.C. Gerber , Georg Jansen , Andreas Savin , János G. Angyán
Physical Review Letters, 2009, 102, pp.096404. ⟨10.1103/PhysRevLett.102.096404⟩
Journal articles hal-00978055v1
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Full optimization of Jastrow-Slater wave functions with application to the first-row atoms and homonuclear diatomic molecules

Julien Toulouse , C. J. Umrigar
Journal of Chemical Physics, 2008, 128, pp.174101. ⟨10.1063/1.2908237⟩
Journal articles hal-00979110v1
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Quantum Monte Carlo study of the cooperative binding of NO2 to fragment models of carbon nanotubes

John W.Lawson , Charles Bauschlicher , Julien Toulouse , Claudia Filippi , C.J. Umrigar
Chemical Physics Letters, 2008, 466 (4-6), pp.170-175. ⟨10.1016/j.cplett.2008.10.066⟩
Journal articles hal-03740053v1
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Alleviation of the Fermion-sign problem by optimization of many-body wave functions

C. J. Umrigar , Julien Toulouse , Claudia Filippi , Sandro Sorella , Richard G. Hennig
Physical Review Letters, 2007, 98, pp.110201. ⟨10.1103/PhysRevLett.98.110201⟩
Journal articles hal-00981187v1
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On the universality of the long-/short-range separation in multiconfigurational density-functional theory

Emmanuel Fromager , Julien Toulouse , Hans Jørgen Aa. Jensen
Journal of Chemical Physics, 2007, 126 (7), pp.074111. ⟨10.1063/1.2566459⟩
Journal articles hal-03740061v1
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Optimization of quantum Monte Carlo wave functions by energy minimization

Julien Toulouse , C. J. Umrigar
Journal of Chemical Physics, 2007, 126, pp.084102. ⟨10.1063/1.2437215⟩
Journal articles hal-00981188v1
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Zero-variance zero-bias quantum Monte Carlo estimators of the spherically and system-averaged pair density

Julien Toulouse , Roland Assaraf , C. J. Umrigar
Journal of Chemical Physics, 2007, 126, pp.244112. ⟨10.1063/1.2746029⟩
Journal articles hal-00979441v1
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Local density approximation for long-range or for short-range energy functionals?

Julien Toulouse , Andreas Savin
Journal of Molecular Structure: THEOCHEM, 2006, 762, pp.147. ⟨10.1016/j.theochem.2005.10.014⟩
Journal articles hal-00981823v1
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Scaling relations, virial theorem, and energy densities for long-range and short-range density functionals

Julien Toulouse , Paola Gori-Giorgi , Andreas Savin
International Journal of Quantum Chemistry, 2006, 106, pp.2026. ⟨10.1002/qua.20813⟩
Journal articles hal-00981828v1
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Exchange-correlation potentials and local energies per particle along nonlinear adiabatic connections

Julien Toulouse , Francois Colonna , Andreas Savin
Molecular Physics, 2005, 103, pp.2725-2734. ⟨10.1080/00268970500134615⟩
Journal articles hal-00981840v1
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van der Waals forces in density functional theory: Perturbational long-range electron-interaction corrections

János G. Angyán , I.C. Gerber , Andreas Savin , Julien Toulouse
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2005, 72, pp.012510. ⟨10.1103/PhysRevA.72.012510⟩
Journal articles hal-00981837v1
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Simple model of the static exchange-correlation kernel of a uniform electron gas with long-range electron-electron interaction

Julien Toulouse
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2005, 72, pp.035117. ⟨10.1103/PhysRevB.72.035117⟩
Journal articles hal-00981838v1
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A short-range correlation energy density functional with multi-determinantal reference

Julien Toulouse , Paola Gori-Giorgi , Andreas Savin
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2005, 114, pp.305. ⟨10.1007/s00214-005-0688-2⟩
Journal articles hal-00981834v1
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Long-range-short-range separation of the electron-electron interaction in density-functional theory

Julien Toulouse , Francois Colonna , Andreas Savin
Physical Review A : Atomic, molecular, and optical physics [1990-2015], 2004, 70, pp.062505. ⟨10.1103/PhysRevA.70.062505⟩
Journal articles hal-00981846v1
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Short-range exchange-correlation energy of a uniform electron gas with modified electron-electron interaction

Julien Toulouse , Andreas Savin , Heinz-Juergen Flad
International Journal of Quantum Chemistry, 2004, 100, pp.1047. ⟨10.1002/qua.20259⟩
Journal articles hal-00981847v1
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Short-range exchange and correlation energy density functionals: Beyond the local-density approximation

Julien Toulouse , Francois Colonna , Andreas Savin
Journal of Chemical Physics, 2004, 122, pp.014110. ⟨10.1063/1.1824896⟩
Journal articles hal-00981845v1
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Validation and assessment of an accurate approach to the correlation problem in density functional theory: The Krieger Chen Iafrate Savin model

Julien Toulouse , Andreas Savin , Carlo Adamo
Journal of Chemical Physics, 2002, 117 (23), pp.10465. ⟨10.1063/1.1521432⟩
Journal articles hal-00981216v1
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A new hybrid functional including a meta-GGA approach

Julien Toulouse , Carlo Adamo
Chemical Physics Letters, 2002, 362, pp.72. ⟨10.1016/S0009-2614(02)00950-8⟩
Journal articles hal-00981219v1
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Review of approximations for the exchange-correlation energy in density-functional theory

Julien Toulouse
Eric Cancès; Gero Friesecke. Density-Functional Theory, Springer, inPress
Book sections hal-03773194v1
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Electronic excitation energies of molecular systems from the Bethe-Salpeter equation: Example of the H2 molecule

Elisa Rebolini , Julien Toulouse , Andreas Savin
Swapan Kumar Ghosh and Pratim Kumar Chattaraj. Concepts and Methods in Modern Theoretical Chemistry: Electronic Structure and Reactivity, CRC Press, pp.367-390, 2013, Atoms, Molecules, and Clusters
Book sections hal-00727788v1
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Quantum Monte Carlo facing the Hartree-Fock symmetry dilemma: The case of hydrogen rings

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