The structures and properties of the MgO(X1∑+) in the external electric field

Authors

ZENG Fanjin, School of Physics and Mathematics, Anshun University, Anshun, Guizhou 561000, China
GUO Xiaotian, School of Physics and Mathematics, Anshun University, Anshun, Guizhou 561000, China; School of Electronics and Information, Guizhou University, Guiyang, Guizhou 550025, China

Abstract

Through the geometry optimization of the ground state of the magnesium oxide molecular, and the theoretical calculation by using b3p86 method combined with 6-311 + + G basis set, the ground state electronic structure of the Magnesium Oxide molecule under the external electric field (-0.015 ~ 0.015 AUA.U.) was obtained. The effect of external electric field on the bond length, energy, energy level distribution, frequency and dipole moment of Magnesium Oxide molecule was discussed. The results show that the electric field effect has obvious effect on the molecular structure of the MgO, and the study can provide some reference for the further study of the MgO in the fields of industry, medicine, feed and food etc.

Publication Date

7-28-2016

First Page

36

Last Page

39

DOI

10.13652/j.issn.1003-5788.2016.07.009

Recommended Citation

Fanjin, ZENG and Xiaotian, GUO (2016) "The structures and properties of the MgO(X1∑+) in the external electric field," Food and Machinery: Vol. 32: Iss. 7, Article 9.
DOI: 10.13652/j.issn.1003-5788.2016.07.009
Available at: https://www.ifoodmm.cn/journal/vol32/iss7/9

References

[1] 百度百科. 氧化镁. (2016-07-20) [2015-10-12]. http://wapbaike.baidu.com/.
[2] 王天成, 贾光, 王翔, 等. 纳米铁、纳米氧化锌和纳米氧化镁对小鼠血清乳酸脱氢酶和α-羟丁酸脱氢酶活性的影响[J]. 实用预防医学, 2006, 13(5): 1 101-1 102.
[3] 李琳, 张露明, 张煜华. 镍负载量对 Ni/MgO（111）催化甲烷二氧化碳重整反应性能影响[J]. 燃料化学学报, 2015, 43(3): 315-322
[4] 满虹. 颗粒饲料氧化镁对奶牛泌乳性能的影响[J]. 饲料研究, 1994(4): 35-35.
[5] 蔡景瑞, 谷丰. 氧化镁添加剂对微弧氧化试样耐蚀性的影响[J]. 四川化工, 2016(2): 45-47.
[6] 姚军, 张明月, 许宁. 保健食品中镁的火焰原子吸收光谱测定法[J]. 职业与健康, 2011, 27(18): 2 093-2 094.
[7] 宇燕, 宋晓书, 龙峰. MgO在外电场作用下的分子特性研究[J]. 四川大学学报: 自然科学版, 2009, 46(3): 749-755.
[8] 黄多辉, 王藩侯, 闵军. 外电场作用下MgO分子的特性研究[J]. 物理学报, 2009, 58(5): 3 052-3 057.
[9] 谢国秋. 原子分子物理研究[J]. 黄山学院学报, 2007, 9(3): 20-27.
[10] 肖夏杰, 韩晓琴, 刘玉芳. BFX(X=-1,0,+1)分子离子基态的结构与势能函数研究[J]. 原子分子物理学报, 2010, 27(6): 1 075-1 080.
[11] 朱正和, 傅依备, 高涛. H的外场效应[J]. 原子与分子物理学报, 2003, 20(2): 169-172.
[12] 徐国亮, 刘玉兰, 孙金峰. 外电场作用下SiO电子结构特性研究[J]. 物理学报, 2007, 56(10): 5 704-5 708.