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Huanchen Zhai

Associate Research Scientist - Software

Flatiron Institute

United States

Research Interests

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Articles (17)

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2026

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2026

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2026

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2025

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2024

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2023

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2023

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2023

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2023

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2023

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2023

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2023

Collaborators (8)

Daniel Kats

Group Leader

Max Planck Institute for Solid State Research

GERMANY

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Susi Lehtola

Software Scientist

University of Helsinki

FINLAND

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Chenghan Li

University of Chicago

UNITED STATES

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Tianyu Zhu

University of Helsinki

FINLAND

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Seunghoon Lee

Assistant Professor

Seoul National University

SOUTH KOREA

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Hao Jiang

Lund University

SWEDEN

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Xiao Wang

Assistant Professor

University of California, Santa Cruz

UNITED STATES

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Wenyuan Liu

Professor

Zhejiang University

CHINA

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Huanchen Zhai

Research Interests

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Articles (17)

The Python simulations of chemistry framework

High-performance parallel implementation of spin-free high-order coupled-cluster theories

Coupled-cluster imaginary-time evolution and the coupled-cluster energy variance

Toward an exact quantum many-body treatment of Kondo correlation in magnetic impurities

Towards excitations and dynamical quantities in correlated lattices with density matrix embedding theory

Quantum many-body linear algebra, Hamiltonian moments, and a coupled-cluster inspired framework

Accurate Simulation of the Hubbard Model with Finite Fermionic Projected Entangled Pair States

Driven Similarity Renormalization Group with a Large Active Space: Applications to Oligoacenes, Zeaxanthin, and Chromium Dimer

Benchmarking the exponential ansatz for the Holstein model

Fast Emulation of Fermionic Circuits with Matrix Product States

Assessment of DFT functionals for a minimal nitrogenase [Fe(SH)4H]− model employing state-of-the-art ab initio methods

Block2: A comprehensive open source framework to develop and apply state-of-the-art DMRG algorithms in electronic structure and beyond

Density Matrix Renormalization Group for Transcorrelated Hamiltonians: Ground and Excited States in Molecules

Multireference Protonation Energetics of a Dimeric Model of Nitrogenase Iron–Sulfur Clusters

An Ab Initio Correction Vector Restricted Active Space Approach to the L-Edge XAS and 2p3d RIXS Spectra of Transition Metal Complexes

Hierarchical Clifford Transformations to Reduce Entanglement in Quantum Chemistry Wave Functions

Interacting models for twisted bilayer graphene: A quantum chemistry approach

Collaborators (8)

Daniel Kats

Susi Lehtola

Chenghan Li

Tianyu Zhu

Seunghoon Lee

Hao Jiang

Xiao Wang

Wenyuan Liu

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