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October 22, 2025 article

Interlayer multi-level orbital coupling in 2D materials: Beyond the two-level paradigm

The Journal of Chemical Physics

DOI: 10.1063/5.0300415 OpenAlex

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References 6

LOBSTER : Local orbital projections, atomic charges, and chemical‐bonding analysis from projector‐augmented‐wave‐based density‐functional theory
2020 Journal of Computational Chemistry article Physics and Astronomy Advanced Chemical Physics Studies Open access

1,585

citations
Crystal Orbital Bond Index: Covalent Bond Orders in Solids
2021 The Journal of Physical Chemistry C article Physics and Astronomy Advanced Chemical Physics Studies Open access

392

citations
The Orbital Origins of Chemical Bonding in Ge−Sb−Te Phase‐Change Materials**
2022 Angewandte Chemie International Edition article Materials Science Phase-change materials and chalcogenides Open access

66

citations
Fragment Orbitals Extracted from First-Principles Plane-Wave Calculations
2024 Inorganic Chemistry article Physics and Astronomy Advanced Chemical Physics Studies

37

citations
Chemical bonding in phase-change chalcogenides
2024 Journal of Physics Condensed Matter article Materials Science Phase-change materials and chalcogenides Open access

27

citations
Reply to Comment on ‘Chemical bonding in phase-change chalcogenides’
2025 Journal of Physics Condensed Matter letter Materials Science Phase-change materials and chalcogenides Open access

3

citations

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