Molecular Cycles (H2O)n on the Substrates with Hexagonal Crystal Structure

2019 ◽  
Vol 60 (1) ◽  
pp. 66-74
Author(s):  
S. V. Shevkunov
2020 ◽  
Vol 10 (24) ◽  
pp. 8776
Author(s):  
Sheng-Fang Huang ◽  
Yen-Cheng Chang ◽  
Po-Liang Liu

A new ternary compound Cu2SnTi3 has been synthesized by vacuum sintering at 900 °C. The atomic structures of CaCu5- and InNi2-like Cu2SnTi3 are calculated using density functional theory methods. The X-ray diffraction (XRD) analysis and selected area diffraction (SAD) patterns of the new ternary compound Cu2SnTi3 are considered to verify the atomic structures of CaCu5- and InNi2-like Cu2SnTi3. The results reveal that the InNi2-like Cu2SnTi3 model has the lowest total energy of −35.239 eV, representing the trigonal crystal structure. The orthorhombic crystal structure of the CaCu5-like Cu2SnTi3 model has the second lowest total energy of −33.926 eV. Our theoretical X-ray diffraction peak profiles of InNi2-like (CaCu5-like) Cu2SnTi3 are nearly identical to experimental one, leading to an error below 2.0% (3.0%). In addition, the hexagonal crystal structure of the CaCu5-like Cu2SnTi3 model has the highest total energy of −33.094 eV. The stability of the Cu2SnTi3 in terms of energy follows the order: the trigonal, orthorhombic, and hexagonal crystal structure.


2010 ◽  
Vol 152-153 ◽  
pp. 674-678 ◽  
Author(s):  
Bing Wang ◽  
Li Dan Tang ◽  
Jian Zhong Wang

Nanocrystalline ZnO powders have been synthesized by a novel combustion synthesis method using glycine and urea as mixed fuels and zinc nitrates as oxidant. The as-synthesized ZnO powders are characterized by DSC, XRD and SEM. Results show that the as-synthesized ZnO powders show well crystalline with hexagonal crystal structure and purity without any other impurities and the particle sizes are about 50~70nm calculated by the Scherrer formula.


2013 ◽  
Vol 802 ◽  
pp. 227-231
Author(s):  
Panida Pilasuta ◽  
Pennapa Muthitamongkol ◽  
Chanchana Thanachayanont ◽  
Tosawat Seetawan

Crystal structure of Zn0.96Al0.02Ga0.02O was analyzed by X-Ray diffraction (XRD) technique and the microstructure was observed by scanning electron microscopy (SEM), and transmission electron microscopy (TEM). The XRD results showed single phase and hexagonal structure a = b = 3.24982 Å, and c = 5.20661 Å. The SEM and TEM results showed the grain size of material arrangement changed after sintering and TEM diffraction pattern confirmed hexagonal crystal structure of Zn0.96Al0.02Ga0.02O after sintering.


2013 ◽  
Vol 197 ◽  
pp. 402-407 ◽  
Author(s):  
Tatsuya Nishimura ◽  
Saburo Hosokawa ◽  
Yuichi Masuda ◽  
Kenji Wada ◽  
Masashi Inoue

2015 ◽  
Vol 96 (9) ◽  
pp. 1519-1531 ◽  
Author(s):  
Benjamin J. Murray ◽  
Christoph G. Salzmann ◽  
Andrew J. Heymsfield ◽  
Steven Dobbie ◽  
Ryan R. Neely ◽  
...  

Abstract We are all familiar with the hexagonal shape of snow and ice crystals, and it is well established that their sixfold symmetry is derived from the arrangement of water molecules in a hexagonal crystal structure. However, atmospheric ice crystals with only threefold rotational symmetry are often observed, which is inconsistent with the hexagonal crystal structure of ordinary ice. These crystals are found in a wide range of different cloud types ranging from upper-tropospheric cirrus to contrails and diamond dust and they form at temperatures ranging from about −84° to −5°C. Recent experimental studies of ice crystal structures have shown that ice under a wide range of atmospheric conditions does not always conform to the standard hexagonal crystal structure. Instead, sequences of the hexagonal structure can be interlaced with cubic sequences to create stacking-disordered ice. This degrades the symmetry of the crystal structure so that, instead of having a hexagonal structure, they have a trigonal structure with a corresponding threefold symmetry. Hence, this implies that atmospheric ice crystals with threefold symmetry are made of stacking-disordered ice. We conclude that the presence of trigonal crystals in the atmosphere is consistent with rare Parry arc halos and also show that they have distinct radiative properties compared with hexagonal ice.


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