The unusual physical properties and formation conditions attributed to h-, i-, m-, and n-nanodiamond polymorphs has resulted in their receiving much attention in the materials and planetary science literature. Their identification is based on diffraction features that are absent in ordinary cubic (c-) diamond (space group: Fd-3m). We show, using ultra-high-resolution transmission electron microscope (HRTEM) images of natural and synthetic nanodiamonds, that the diffraction features attributed to the reported polymorphs are consistent with c-diamond containing abundant defects. Combinations of {113} reflection and <011> rotation twins produce HRTEM images and d-spacings that match those attributed to h-, i-, and m-diamond. The diagnostic features of n-diamond in TEM images can arise from thickness effects of c-diamonds. Our data and interpretations strongly suggest that the reported nanodiamond polymorphs are in fact twinned c-diamond. We also report a new type of twin (<121> rotational), which can give rise to grains with dodecagonal symmetry. Our results show that twins are widespread in diamond nanocrystals. A high density of twins could strongly influence their applications.
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http://dx.doi.org/10.1038/srep18381 | DOI Listing |
Micromachines (Basel)
January 2025
Jilin Province Product Quality Supervision and Inspection Institute, Changchun 130103, China.
Observing the intricate microstructure changes in abrasive flow machining with traditional experimental methods is difficult. Molecular dynamics simulations are used to look at the process of abrasive flow processing from a microscopic scale in this work. A molecular dynamics model for micro-cutting a single crystal γ-TiAl alloy with a rough surface in a fluid medium environment is constructed, which is more realistic.
View Article and Find Full Text PDFJ Mater Chem B
January 2025
State Key Laboratory of Oral Diseases, National Clinical Research Center for Oral Diseases, West China Hospital of Stomatology, Sichuan University, Chengdu 610041, China.
Achieving microecological balance is a complex environmental challenge. This is because the equilibrium of microecological systems necessitates both the eradication of harmful microorganisms and preservation of the beneficial ones. Conventional materials predominantly target the elimination of pathogenic microorganisms and often neglect the protection of advantageous microbial species.
View Article and Find Full Text PDFSoft Matter
January 2025
Department of Theoretical Chemistry, Institute of Chemical Sciences, Faculty of Chemistry, Maria-Curie-Sklodowska University in Lublin, Pl. M Curie-Sklodowskiej 3, 20-031 Lublin, Poland.
The achievement of selectivity in the formation of cubic diamond is challenging due to the emergence of competing phases such as its hexagonal polymorph or clathrates possessing similar free energy. Although both polymorphs exhibit a complete photonic bandgap, cubic diamond exhibits it at lower frequencies than the hexagonal counterpart, positioning it as a promising candidate for photonic applications. Herein, we demonstrate that the 1 : 1 mixture of identical patchy particles cannot selectively form the cubic diamond polymorph due to the frustrations present in the system that are manifested in the primary adsorption layer and propagate as the film grows.
View Article and Find Full Text PDFJ Am Chem Soc
January 2025
School of Materials, Shenzhen Campus of Sun Yat-sen University, Shenzhen 518107, China.
Hexagonal diamond (HD) was reported 60 years ago and has attracted extensive attention owing to its ultrahigh theoretical hardness, 58% superior to its cubic counterpart. However, to date, synthesizing pure HD under high-pressure and high-temperature (HPHT) remains unsuccessful due to the limitations of understanding the formation mechanism. In this work, employing a systematic molecular dynamics simulation, we directly observe the graphite-to-HD transition in a nucleation-growth mechanism.
View Article and Find Full Text PDFNanoscale
December 2024
Department of Chemistry, Virginia Commonwealth University, Richmond, Virginia 23284-2006, USA.
SiGe alloy nanocrystals (NCs) are a class of benign semiconductors that show size and composition-tunable energy gaps and promising optical properties because of the lattice disorder. The random distribution of elements within the alloys can lead to efficient light-matter interactions, making them attractive for Si-compatible optoelectronic devices, transistors, charge storage, and memory applications. However, the fabrication of discrete, quantum-confined alloys has proved a challenging task.
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