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All papers authored by Anthony Scemama

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2023 Abdallah Ammar

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, Anthony Scemama

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, Emmanuel Giner

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Transcorrelated selected configuration interaction in a bi-orthonormal basis and with a cheap three-body correlation factor

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Abdallah Ammar

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, Anthony Scemama

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, Emmanuel Giner

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Biorthonormal Orbital Optimization with a Cheap Core-Electron-Free Three-Body Correlation Factor for Quantum Monte Carlo and Transcorrelation

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Evgeny Posenitskiy

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, Vijay Gopal Chilkuri

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, Abdallah Ammar

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, Michał Hapka, Katarzyna Pernal

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, Ravindra Shinde

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, Edgar Josué Landinez Borda

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, Claudia Filippi

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, Kosuke Nakano

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, Otto Kohulák, Sandro Sorella

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, Pablo de Oliveira Castro

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, William Jalby, Pablo López Ríos

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and 1 other authors

TREXIO: A file format and library for quantum chemistry

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2022 Abdallah Ammar

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, Anthony Scemama

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, Emmanuel Giner

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Extension of selected configuration interaction for transcorrelated methods

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Abdallah Ammar

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, Emmanuel Giner

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, Anthony Scemama

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Optimization of Large Determinant Expansions in Quantum Monte Carlo

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This paper was not found in any repository, but could be made available legally by the author.

This paper was not found in any repository, but could be made available legally by the author.

Anthony Scemama

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, Emmanuel Giner

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, Anouar Benali

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, Pierre-François Loos

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Taming the fixed-node error in diffusion Monte Carlo via range separation

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2018 Yann Garniron

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, Anthony Scemama

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, Emmanuel Giner

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, Michel Caffarel

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, Pierre-François Loos

Selected configuration interaction dressed by perturbation

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Anthony Scemama

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, Anouar Benali

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, Denis Jacquemin, Michel Caffarel

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, Pierre-François Loos

Excitation energies from diffusion Monte Carlo using selected configuration interaction nodes

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2017 Yann Garniron

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, Anthony Scemama

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, Pierre-François Loos, Michel Caffarel

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Hybrid stochastic-deterministic calculation of the second-order perturbative contribution of multireference perturbation theory

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Emmanuel Giner

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, Celestino Angeli

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, Yann Garniron

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, Anthony Scemama

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, Jean-Paul Malrieu

A Jeziorski-Monkhorst fully uncontracted Multi-Reference perturbative treatment I: principles, second-order versions and tests on ground state potential energy curves

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2016 Michel Caffarel

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, Thomas Applencourt

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, Emmanuel Giner

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, Anthony Scemama

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Communication: Toward an improved control of the fixed-node error in quantum Monte Carlo: The case of the water molecule

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E. Giner

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, G. David

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, A. Scemama

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, J. P. Malrieu

A simple approach to the state-specific MR-CC using the intermediate Hamiltonian formalism

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