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The Journal of Physical Chemistry. A|October 13, 2025
Implementation of McMurchie-Davidson Algorithm for Gaussian AO Integrals Suited for SIMD ProcessorsAndrey Asadchev, Edward F ValeevJournal of Chemical Theory and Computation|March 14, 2023
Memory-Efficient Recursive Evaluation of 3-Center Gaussian IntegralsAndrey Asadchev, Edward F ValeevThe Journal of Chemical Physics|June 27, 2024
3-center and 4-center 2-particle Gaussian AO integrals on modern accelerated processorsAndrey Asadchev, Edward F ValeevThe Journal of Physical Chemistry. A|December 13, 2023
High-Performance Evaluation of High Angular Momentum 4-Center Gaussian Integrals on Modern Accelerated ProcessorsAndrey Asadchev, Edward F ValeevThe Journal of Chemical Physics|June 16, 2023
Distributed memory, GPU accelerated Fock construction for hybrid, Gaussian basis density functional theoryDavid B Williams-Young, Andrey Asadchev, Doru Thom Popovici, et al.Journal of Chemical Theory and Computation|November 26, 2015
New Multithreaded Hybrid CPU/GPU Approach to Hartree-FockAndrey Asadchev, Mark S GordonPhysical Chemistry Chemical Physics : PCCP|December 14, 2007
Coupled-cluster methods with perturbative inclusion of explicitly correlated terms: a preliminary investigationEdward F ValeevJournal of Chemical Theory and Computation|November 20, 2015
Fast and Flexible Coupled Cluster ImplementationAndrey Asadchev, Mark S GordonThe Journal of Chemical Physics|January 4, 2007
Combining explicitly correlated R12 and Gaussian geminal electronic structure theoriesEdward F ValeevPhysical Chemistry Chemical Physics : PCCP|May 8, 2012
Hybrid one-electron/many-electron methods for ionized states of molecular clustersJinmei Zhang, Edward F ValeevPageof 9