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Title: :  Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study
PaperId: :  13190
Published in:   International Journal Of Advance Research And Innovative Ideas In Education
Publisher:   IJARIIE
e-ISSN:   2395-4396
Volume/Issue:    Volume 6 Issue 6 2020
DUI:    16.0415/IJARIIE-13190
Licence: :   IJARIIE is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

Author NameAuthor Institute
Mohammad Daud AhmmadzaiPhysics Department, Electromechanics Faculty,Kabul Polytechnics University,Karte-Mamorin, Kabul, Afghanistan
Ahad Khan PyawaraiPhysics Department, Electromechanics Faculty,Kabul Polytechnics University,Karte-Mamorin, Kabul, Afghanistan

Abstract

Physics
DFT,Ion Radii, Ion-Ion interaction
In this study, we have reported the bond length of Na-Na, Na-Mg, and Mg-Mg bu using a DFT study. In order to do it, we used a full scan to calculate bond lengths. We used 17 functional along 24 basis set. It means for each x-y consideration we have a table made of 17*24 cells. For each configuration, we reported cation, anion, and neutral bond length. At the end of the calculation, we have reported the histogram of bond length and also statistics of them.

Citations

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IJARIIE Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. "Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study" International Journal Of Advance Research And Innovative Ideas In Education Volume 6 Issue 6 2020 Page 892-897
MLA Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. "Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study." International Journal Of Advance Research And Innovative Ideas In Education 6.6(2020) : 892-897.
APA Mohammad Daud Ahmmadzai, & Ahad Khan Pyawarai. (2020). Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study. International Journal Of Advance Research And Innovative Ideas In Education, 6(6), 892-897.
Chicago Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. "Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study." International Journal Of Advance Research And Innovative Ideas In Education 6, no. 6 (2020) : 892-897.
Oxford Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. 'Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study', International Journal Of Advance Research And Innovative Ideas In Education, vol. 6, no. 6, 2020, p. 892-897. Available from IJARIIE, https://ijariie.com/AdminUploadPdf/Calculation_of_bond_length_of_Na_Na__Mg_Mg__and_Na_Mg__A_DFT_study_ijariie13190.pdf (Accessed : 07 December 2020).
Harvard Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. (2020) 'Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study', International Journal Of Advance Research And Innovative Ideas In Education, 6(6), pp. 892-897IJARIIE [Online]. Available at: https://ijariie.com/AdminUploadPdf/Calculation_of_bond_length_of_Na_Na__Mg_Mg__and_Na_Mg__A_DFT_study_ijariie13190.pdf (Accessed : 07 December 2020)
IEEE Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai, "Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study," International Journal Of Advance Research And Innovative Ideas In Education, vol. 6, no. 6, pp. 892-897, Nov-Dec 2020. [Online]. Available: https://ijariie.com/AdminUploadPdf/Calculation_of_bond_length_of_Na_Na__Mg_Mg__and_Na_Mg__A_DFT_study_ijariie13190.pdf [Accessed : 07 December 2020].
Turabian Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. "Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study." International Journal Of Advance Research And Innovative Ideas In Education [Online]. volume 6 number 6 (07 December 2020).
Vancouver Mohammad Daud Ahmmadzai, and Ahad Khan Pyawarai. Calculation of bond length of Na-Na, Mg-Mg, and Na-Mg: A DFT study. International Journal Of Advance Research And Innovative Ideas In Education [Internet]. 2020 [Cited : 07 December 2020]; 6(6) : 892-897. Available from: https://ijariie.com/AdminUploadPdf/Calculation_of_bond_length_of_Na_Na__Mg_Mg__and_Na_Mg__A_DFT_study_ijariie13190.pdf
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