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Updated: Oct 12, 2025

Probe Type II Band Alignment in One-Dimensional Van Der Waals Heterostructures Using First-Principles Calculations
Published on: October 12, 2019
AA BN crystal, basic structure of boron nitride nanotubes
Jae-Kap Lee1, Jin-Gyu Kim2, Seunggun Yu3
1Opto-Electronic Materials and Devices Research Center, Korea Institute of Science and Technology (KIST), Seoul, 02792, Republic of Korea.
Abstract:
AA boron nitride (BN) crystal, assigned to an orthorhombic space group (No. 31, Pm21), is reported here. This new AA BN crystal exhibits a 'linear' morphology for high-resolution transmission electron microscopy (HRTEM) and a (non-hexagonal) 'diagonal' electron-diffraction pattern, which have been experimentally demonstrated in this article. It is also demonstrated that this new crystal is the basic structure of multi-walled BN nanotubes (BNNTs) existing in the form of a helix. The helical AA BNNTs exist in a metastable phase owing to 〈200〉 texture growth of the orthorhombic crystal, where the energy is ∼15 meV higher than that of stable AB or AA' BN. It is shown that the typical scanning electron microscope 'fluffy cotton-like' morphology of BNNTs is due to secondary growth of diverse BN sheets (including mono-layers) on incoherently scrolled wall strands of BNNTs, providing further evidence for the helical structure with HRTEM evidence for a left-handed helix.
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