Julien Toulouse

100

Documents

Researcher identifiers

julientoulouse
Arxiv : toulouse_j_1
ResearcherId : A-1376-2010
0000-0003-2855-1835
IdRef : 094203504
Google Scholar : https://scholar.google.fr/citations?user=Vqb0BgYAAAAJ
ResearcherId : http://www.researcherid.com/rid/A-1376-2010

Presentation

Publications

	Accelerated basis-set convergence of coupled-cluster excitation energies using the density-based basis-set correction method Diata Traore , Julien Toulouse , Emmanuel Giner Faraday Discussions, 2024, ⟨10.1039/D4FD00033A⟩ Journal articles hal-04475187v2
	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, inPress, ⟨10.1002/jcc.27325⟩ Journal articles hal-04210752v2
	Effective quantum electrodynamics: One-dimensional model of the relativistic hydrogen-like atom Timothée Audinet , Julien Toulouse The Journal of Chemical Physics, 2023, 158, pp.244108. ⟨10.1063/5.0152956⟩ Journal articles hal-04102685v2
	Semiclassical approximations of photoabsorption cross sections beyond the continuum threshold Julien Toulouse The European physical journal. A, Hadrons and Nuclei, 2023, Topical Collection devoted to the legacy of Peter Schuck, 59 (98), ⟨10.1140/epja/s10050-023-01015-6⟩ Journal articles hal-04078106v1
	Basis-set correction based on density-functional theory: Linear-response formalism for excited-state energies Diata Traore , Emmanuel Giner , Julien Toulouse The Journal of Chemical Physics, 2023, 158, pp.234107. ⟨10.1063/5.0156317⟩ Journal articles hal-04107625v1
	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
	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 The Journal of Chemical Physics, 2022, 155, pp.044109 Journal articles hal-03234580v1
	Basis-set correction for coupled-cluster estimation of dipole moments Diata Traore , Julien Toulouse , Emmanuel Giner The Journal of Chemical Physics, 2022, 156 (17), ⟨10.1063/5.0087794⟩ Journal articles hal-03588392v2
	Basis-set correction based on density-functional theory: Rigorous framework for a one-dimensional model Diata Traore , Emmanuel Giner , Julien Toulouse The Journal of Chemical Physics, 2022, 156, pp.044113. ⟨10.1063/5.0076128⟩ Journal articles hal-03391682v3
	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 The Journal of Chemical Physics, 2022, 156 (22), pp.224106. ⟨10.1063/5.0091073⟩ Journal articles hal-03605574v2
	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 The 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 The Journal of Chemical Physics, 2021, 155 (4), pp.044109. ⟨10.1063/5.0057957⟩ Journal articles hal-03453816v1
	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
	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 The Journal of Chemical Physics, 2020, 153 (12), pp.124117. ⟨10.1063/5.0018577⟩ Journal articles hal-02991165v1
	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
	Relativistic short-range exchange energy functionals beyond the local-density approximation Julien Paquier , Emmanuel Giner , Julien Toulouse The Journal of Chemical Physics, In press Journal articles hal-02480263v2
	A basis-set error correction based on density-functional theory for strongly correlated molecular systems Emmanuel Giner , Anthony Scemama , Pierre-François Loos , Julien Toulouse The Journal of Chemical Physics, 2020, 152, pp.174104. ⟨10.1063/5.0002892⟩ Journal articles hal-02458920v2
	Chemically Accurate Excitation Energies With Small Basis Sets Emmanuel Giner , Anthony Scemama , Julien Toulouse , Pierre-Francois Loos The Journal of Chemical Physics, 2019, 151 (14), pp.144118. ⟨10.1063/1.5122976⟩ Journal articles hal-02289341v2
	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
	Range-separated double-hybrid density-functional theory with coupled-cluster and random-phase approximations Cairedine Kalai , Bastien Mussard , Julien Toulouse The Journal of Chemical Physics, 2019, 151, pp.074102. ⟨10.1063/1.5108536⟩ Journal articles hal-02114946v2
	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
	Linear-response range-separated density-functional theory for atomic photoexcitation and photoionization spectra Felipe Zapata , Eleonora Luppi , Julien Toulouse The Journal of Chemical Physics, inPress, 150, pp.234104. ⟨10.1063/1.5096037⟩ Journal articles hal-02072512v2
	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
	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 The Journal of Chemical Physics, 2019, 150 (8), pp.084112. ⟨10.1063/1.5080330⟩ Journal articles hal-01959688v2
	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
	Range-separated multideterminant density-functional theory with a short-range correlation functional of the on-top pair density Anthony Ferté , Emmanuel Giner , Julien Toulouse The Journal of Chemical Physics, inPress Journal articles hal-01990358v1
	A general range-separated double-hybrid density-functional theory Cairedine Kalai , Julien Toulouse The Journal of Chemical Physics, In press, 148, pp.164105 Journal articles hal-01761092v1
	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
	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
	Four-component relativistic range-separated density-functional theory: Short-range exchange local-density approximation Julien Paquier , Julien Toulouse The Journal of Chemical Physics, 2018 Journal articles hal-01942323v1
	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 The Journal of Chemical Physics, 2018, 149, pp.194301. ⟨10.1063/1.5052714⟩ Journal articles hal-01865504v1
	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
	Multiconfigurational short-range density-functional theory for open-shell systems Erik Donovan Hedegård , Julien Toulouse , Hans Jørgen Aa. Jensen The Journal of Chemical Physics, 2018, 148, pp.214103. ⟨10.1063/1.5013306⟩ Journal articles hal-01832349v1
	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 The Journal of Chemical Physics, 2017, 147, pp.014106. ⟨10.1063/1.4991563⟩ Journal articles hal-01546677v1
	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
	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
	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
	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
	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
	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
	Blind test of density-functional-based methods on intermolecular interaction energies Decarlos Taylor , János Ángyán , Giulia Galli , Cui Zhang , Francois Gygi The Journal of Chemical Physics, 2016, 145 (12), pp.124105. ⟨10.1063/1.4961095⟩ Journal articles hal-03958068v1
	Self-consistent double-hybrid density-functional theory using the optimized-effective-potential method Szymon Smiga , Odile Franck , Bastien Mussard , Adam Buksztel , Ireneusz Grabowski The Journal of Chemical Physics, 2016, 145, pp.144102. ⟨10.1063/1.4964319⟩ Journal articles hal-01346158v2
	Range-separated time-dependent density-functional theory with a frequency-dependent second-order Bethe-Salpeter correlation kernel Elisa Rebolini , Julien Toulouse The Journal of Chemical Physics, 2016, 144, pp.094107. ⟨10.1063/1.4943003⟩ Journal articles hal-01184145v3
	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
	Range-separated double-hybrid density-functional theory applied to periodic systems Giuseppe Sansone , Bartolomeo Civalleri , Denis Usvyat , Julien Toulouse , Kamal Sharkas The Journal of Chemical Physics, 2015, 143, pp.102811. ⟨10.1063/1.4922996⟩ Journal articles hal-01165841v1
	Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights. Bastien Mussard , Peter Reinhardt , Janos Angyan , Julien Toulouse The Journal of Chemical Physics, 2015, pp.00. ⟨10.1063/1.4918710⟩ Journal articles hal-01141968v2
	Basis convergence of range-separated density-functional theory Odile Franck , Bastien Mussard , Eleonora Luppi , Julien Toulouse The Journal of Chemical Physics, 2015, 142, pp.074107. ⟨10.1063/1.4907920⟩ Journal articles hal-01081816v2
	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
	Double-hybrid density-functional theory applied to molecular crystals Kamal Sharkas , Julien Toulouse , Lorenzo Maschio , Bartolomeo Civalleri The Journal of Chemical Physics, 2014, 141, pp.044105. ⟨10.1063/1.4890439⟩ Journal articles hal-01018205v1
	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
	Double-hybrid density-functional theory with meta-generalized-gradient approximations Sidi Ould Souvi , Kamal Sharkas , Julien Toulouse The Journal of Chemical Physics, 2014, 140, pp.084107. ⟨10.1063/1.4865963⟩ Journal articles hal-00920176v2
	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
	Excitation energies along a range-separated adiabatic connection Elisa Rebolini , Julien Toulouse , Andrew M. Teale , Trygve Helgaker , Andreas Savin The Journal of Chemical Physics, 2014, 141, pp.044123. ⟨10.1063/1.4890652⟩ Journal articles hal-00985367v2
	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 The Journal of Chemical Physics, 2013, 139, pp.134113 Journal articles hal-00967719v1
	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 The Journal of Chemical Physics, 2013, 138, pp.194106. ⟨10.1063/1.4804981⟩ Journal articles hal-00819369v2
	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
	A multiconfigurational hybrid density-functional theory Kamal Sharkas , Andreas Savin , Hans Jørgen Aa. Jensen , Julien Toulouse The Journal of Chemical Physics, 2012, 137 (4), pp.044104. ⟨10.1063/1.4733672⟩ Journal articles hal-00724033v1
	Approaching chemical accuracy with quantum Monte Carlo Frank R. Petruzielo , Julien Toulouse , C. J. Umrigar The Journal of Chemical Physics, 2012, 136, pp.124116. ⟨10.1063/1.3697846⟩ Journal articles hal-00974223v1
	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
	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 The Journal of Chemical Physics, 2011, 134, pp.064104. ⟨10.1063/1.3551512⟩ Journal articles hal-00974320v1
	Rationale for a new class of double-hybrid approximations in density-functional theory Julien Toulouse , Kamal Sharkas , Eric Brémond , Carlo Adamo The Journal of Chemical Physics, 2011, 135 (10), pp.101102. ⟨10.1063/1.3640019⟩ Journal articles hal-00618140v1
	Double-hybrid density-functional theory made rigorous Kamal Sharkas , Julien Toulouse , Andreas Savin The Journal of Chemical Physics, 2011, 134 (6), pp.064113. ⟨10.1063/1.3544215⟩ Journal articles hal-00550562v2
	Quantum Monte Carlo with Jastrow-valence-bond wave functions Benoît Braïda , Julien Toulouse , Michel Caffarel , C. J. Umrigar The Journal of Chemical Physics, 2011, 134 (8), pp.084108. ⟨10.1063/1.3555821⟩ Journal articles hal-00553700v2
	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 The Journal of Chemical Physics, 2011, 135 (8), pp.084119. ⟨10.1063/1.3626551⟩ Journal articles hal-00612814v2
	Compact and flexible basis functions for quantum Monte Carlo calculations Frank R. Petruzielo , Julien Toulouse , C. J. Umrigar The Journal of Chemical Physics, 2010, 132, pp.094109. ⟨10.1063/1.334206⟩ Journal articles hal-00978167v1
	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 The Journal of Chemical Physics, 2010, 133 (5), pp.054301. ⟨10.1063/1.3465552⟩ Journal articles hal-03740042v1
	Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions Wuming Zhu , Julien Toulouse , Andreas Savin , János G. Angyán The Journal of Chemical Physics, 2010, 132, pp.244108. ⟨10.1063/1.3431616⟩ Journal articles hal-00976481v1
	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
	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
	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
	Excited states of methylene from quantum Monte Carlo Paul Zimmerman , Julien Toulouse , Zhiyong Zhang , Charles Musgrave , C. Umrigar The Journal of Chemical Physics, 2009, 131 (12), pp.124103. ⟨10.1063/1.3220671⟩ Journal articles hal-03740048v1
	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
	Full optimization of Jastrow-Slater wave functions with application to the first-row atoms and homonuclear diatomic molecules Julien Toulouse , C. J. Umrigar The Journal of Chemical Physics, 2008, 128, pp.174101. ⟨10.1063/1.2908237⟩ Journal articles hal-00979110v1
	Optimization of quantum Monte Carlo wave functions by energy minimization Julien Toulouse , C. J. Umrigar The Journal of Chemical Physics, 2007, 126, pp.084102. ⟨10.1063/1.2437215⟩ Journal articles hal-00981188v1
	On the universality of the long-/short-range separation in multiconfigurational density-functional theory Emmanuel Fromager , Julien Toulouse , Hans Jørgen Aa. Jensen The Journal of Chemical Physics, 2007, 126 (7), pp.074111. ⟨10.1063/1.2566459⟩ Journal articles hal-03740061v1
	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
	Zero-variance zero-bias quantum Monte Carlo estimators of the spherically and system-averaged pair density Julien Toulouse , Roland Assaraf , C. J. Umrigar The Journal of Chemical Physics, 2007, 126, pp.244112. ⟨10.1063/1.2746029⟩ Journal articles hal-00979441v1
	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
	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
	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
	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
	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
	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
	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
	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
	Short-range exchange and correlation energy density functionals: Beyond the local-density approximation Julien Toulouse , Francois Colonna , Andreas Savin The Journal of Chemical Physics, 2004, 122, pp.014110. ⟨10.1063/1.1824896⟩ Journal articles hal-00981845v1
	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 The Journal of Chemical Physics, 2002, 117 (23), pp.10465. ⟨10.1063/1.1521432⟩ Journal articles hal-00981216v1
	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

	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
	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
	Quantum Monte Carlo facing the Hartree-Fock symmetry dilemma: The case of hydrogen rings Peter Reinhardt , Julien Toulouse , Roland Assaraf , C. J. Umrigar , Philip E. Hoggan S. Tanaka, S. M. Rothstein, and W. A. Lester, Jr. Advances in Quantum Monte Carlo, ACS, pp.53, 2012, ACS Symposium Series, Vol. 1094, ⟨10.1021/bk-2012-1094.ch005⟩ Book sections hal-00609374v1
	Quantum Monte Carlo calculations of electronic excitation energies: the case of the singlet n to pi* (CO) transition in acrolein Julien Toulouse , Michel Caffarel , Peter Reinhardt , Philip E. Hoggan , C. J. Umrigar P. E. Hoggan, J. Maruani, P. Piecuch, G. Delgado-Barrio and E. J. Brandas. Advances in the Theory of Quantum Systems in Chemistry and Physics, Springer, pp.343-351, 2011, Progress in Theoretical Chemistry and Physics, Vol. 22, ⟨10.1007/978-94-007-2076-3⟩ Book sections hal-00550057v1
	Model hamiltonians in density functional theory Paola Gori-Giorgi , Julien Toulouse , Andreas Savin André Bandrauk, Michel C. Delfour, Claude Le Bris. High-Dimensional Partial Differential Equations in Science and Engineering, AMS, pp.117, 2007, CRM Proceedings & Lecture Notes Vol. 41 Book sections hal-00981803v1

	Vacuum polarization in a one-dimensional effective quantum-electrodynamics model Timothée Audinet , Umberto Morellini , Antoine Levitt , Julien Toulouse 2024 Preprints, Working Papers, ... hal-04752718v1
	The Valence-Bond Quantum Monte Carlo Method Slavko Radenković , Dominik Domin , Julien Toulouse , Benoît Braïda 2022 Preprints, Working Papers, ... hal-03740416v1
	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 2022 Preprints, Working Papers, ... hal-03849878v1
	Relativistic density-functional theory based on effective quantum electrodynamics Julien Toulouse 2022 Preprints, Working Papers, ... hal-03164401v1

	Extension multidéterminantale de la méthode de Kohn-Sham en théorie de la fonctionnelle de la densité par décomposition de l'interaction électronique en contributions de longue portée et de courte portée Julien Toulouse Chimie. Université Pierre et Marie Curie - Paris VI, 2005. Français. ⟨NNT : 2005PA066252⟩ Theses tel-00550772v1

	Développements méthodologiques en chimie quantique : méthodes de Monte Carlo quantique et théorie de la fonctionnelle de la densité Julien Toulouse Chimie théorique et/ou physique. Université Pierre et Marie Curie - Paris VI, 2012 Accreditation to supervise research tel-00851489v1

	Introduction to the calculation of molecular properties by response theory Julien Toulouse Master. Paris, France. 2018 Lectures hal-03934866v1

Julien Toulouse

Presentation

Publications

Accelerated basis-set convergence of coupled-cluster excitation energies using the density-based basis-set correction method

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

Effective quantum electrodynamics: One-dimensional model of the relativistic hydrogen-like atom

Semiclassical approximations of photoabsorption cross sections beyond the continuum threshold

Basis-set correction based on density-functional theory: Linear-response formalism for excited-state energies

Systematic lowering of the scaling of Monte Carlo calculations by partitioning and subsampling

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

Basis-set correction for coupled-cluster estimation of dipole moments

Basis-set correction based on density-functional theory: Rigorous framework for a one-dimensional model

Photoionization and core resonances from range-separated density-functional theory: General formalism and example of the beryllium atom

Accurate energies of transition metal atoms, ions, and monoxides using selected configuration interaction and density-based basis-set corrections

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

Short‐range correlation energy of the relativistic homogeneous electron gas

Almost exact energies for the Gaussian-2 set with the semistochastic heat-bath configuration interaction method

Density-Based Basis-Set Incompleteness Correction for GW Methods

Relativistic short-range exchange energy functionals beyond the local-density approximation

A basis-set error correction based on density-functional theory for strongly correlated molecular systems

Chemically Accurate Excitation Energies With Small Basis Sets

Quantum Package 2.0: An Open-Source Determinant-Driven Suite of Programs

Range-separated double-hybrid density-functional theory with coupled-cluster and random-phase approximations

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

Linear-response range-separated density-functional theory for atomic photoexcitation and photoionization spectra

Self-consistent range-separated density-functional theory with second-order perturbative correction via the optimized-effective-potential method

A formally exact one-frequency-only Bethe-Salpeter-like equation. Similarities and differences between GW +BSE and self-consistent RPA

Asymptotic behavior of the Hartree-exchange and correlation potentials in ensemble density functional theory

Range-separated multideterminant density-functional theory with a short-range correlation functional of the on-top pair density

A general range-separated double-hybrid density-functional theory

Range-separated density-functional theory applied to the beryllium dimer and trimer

Excitation energies from Görling-Levy perturbation theory along the range-separated adiabatic connection

Four-component relativistic range-separated density-functional theory: Short-range exchange local-density approximation

Curing basis-set convergence of wave-function theory using density-functional theory: a systematically improvable approach

On the optimal basis set for electron dynamics in strong laser fields: The case of molecular ion H2+

Multiconfigurational short-range density-functional theory for open-shell systems

Ab initio lifetime correction to scattering states for time-dependent electronic-structure calculations with incomplete basis sets

Casimir-Polder size consistency – a constraint violated by some dispersion theories

Time-dependent linear-response variational Monte Carlo

Fractional-charge and fractional-spin errors in range-separated density-functional theory

Introduction to the variational and diffusion Monte Carlo methods

Gaussian continuum basis functions for calculating high-harmonic generation spectra

Quantum Monte Carlo with reoptimised perturbatively selected configuration-interaction wave functions

Blind test of density-functional-based methods on intermolecular interaction energies

Self-consistent double-hybrid density-functional theory using the optimized-effective-potential method

Range-separated time-dependent density-functional theory with a frequency-dependent second-order Bethe-Salpeter correlation kernel

Excited states from range-separated density-functional perturbation theory

Range-separated double-hybrid density-functional theory applied to periodic systems

Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights.

Basis convergence of range-separated density-functional theory

Calculating excitation energies by extrapolation along adiabatic connections

Double-hybrid density-functional theory applied to molecular crystals

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

Double-hybrid density-functional theory with meta-generalized-gradient approximations

Relever le défi de la résolution de l'équation de Schrödinger

Excitation energies along a range-separated adiabatic connection

Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory

Assessment of range-separated time-dependent density-functional theory for calculating C6 dispersion coefficients

Electronic excitations from a linear- response range-separated hybrid scheme

A multiconfigurational hybrid density-functional theory

Approaching chemical accuracy with quantum Monte Carlo

Correlation energy expressions from the adiabatic-connection fluctuation-dissipation theorem approach

Basis set construction for molecular electronic structure theory: Natural orbital and Gauss-Slater basis for smooth pseudopotentials

Rationale for a new class of double-hybrid approximations in density-functional theory

Double-hybrid density-functional theory made rigorous

Quantum Monte Carlo with Jastrow-valence-bond wave functions

Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions

Compact and flexible basis functions for quantum Monte Carlo calculations

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

Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions

Range-separated density-functional theory with the random-phase approximation: Detailed formalism and illustrative applications

Combining density-functional theory and density-matrix-functional theory

Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation

Excited states of methylene from quantum Monte Carlo

Quantum Monte Carlo study of the cooperative binding of NO2 to fragment models of carbon nanotubes

Full optimization of Jastrow-Slater wave functions with application to the first-row atoms and homonuclear diatomic molecules

Optimization of quantum Monte Carlo wave functions by energy minimization

On the universality of the long-/short-range separation in multiconfigurational density-functional theory

Alleviation of the Fermion-sign problem by optimization of many-body wave functions

Zero-variance zero-bias quantum Monte Carlo estimators of the spherically and system-averaged pair density