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From the 1 of 10 linked papers with an AI index.

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20242026
most citedThe Python Simulations of Chemistry Framework: 10 years of an open-source quantum chemistry project

4 citations · 4 across the 4 of their papers we have counts for

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Showing cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2026

Nitrogen Vacancy Centers in Hexagonal Diamond Exhibit Long Coherence Times

Gabriel Kumar, Siyuan Chen, Victor Wen-zhe Yu +1

We show that negatively charged nitrogen-vacancy (NV) centers in the hexagonal diamond polymorph lonsdaleite offer a route to spin qubits with enhanced coherence relative to their…

cond-mat.mtrl-sci2026

Analytical Forces from the Bethe-Salpeter Equation for Large-Scale Excited-State Relaxation

Yu Jin, Victor Wen-zhe Yu, Marco Govoni +1

We present an efficient plane-wave implementation of analytical nuclear forces for electronic excited states described by the Bethe-Salpeter equation (BSE). The formulation combine…

cond-mat.mtrl-sci2026

The WEST code for large-scale excited-state materials simulations

Victor Wen-zhe Yu, Siyuan Chen, Yu Jin +5

The paper introduces WEST, an open‑source plane‑wave pseudopotential code that enables large‑scale excited‑state simulations of materials using GW, Bethe‑Salpeter, and TDDFT method…

cond-mat.mtrl-sci2026

Towards dislocation-driven quantum interconnects

Cunzhi Zhang, Victor Wen-zhe Yu, Yu Jin +4

A central problem in the deployment of quantum technologies is the realization of robust architectures for quantum interconnects. We propose to engineer interconnects in semiconduc…

cond-mat.mtrl-sci2025

Advances in Quantum Defect Embedding Theory

Siyuan Chen, Victor Wen-zhe Yu, Yu Jin +2

Quantum defect embedding theory (QDET) is a many-body embedding method designed to describe condensed systems with correlated electrons localized within a given region of space, fo…

cond-mat.mtrl-sci2025

Many-body perturbation theory with hybrid density functional theory starting points accelerated by adaptively compressed exchange

Victor Wen-zhe Yu, Marco Govoni

We report on the use of the adaptively compressed exchange (ACE) operator to accelerate many-body perturbation theory (MBPT) calculations, including GW and the Bethe Salpet…