The low/room-temperature forms of the lithiated salt of 3,6-dihydroxy-2,5-dimethoxy-p-benzoquinone: a combined experimental and dispersion-corrected density functional study

CrystEngComm ◽  
2013 ◽  
Vol 15 (15) ◽  
pp. 2809 ◽  
Author(s):  
Gaëtan Bonnard ◽  
Anne-Lise Barrès ◽  
Olivier Mentré ◽  
Damian G. Allis ◽  
Carlo Gatti ◽  
...  
Keyword(s):  
Density Functional ◽  
Room Temperature ◽  
Functional Study ◽  
Density Functional Study

Room temperature ferromagnetism in SnO2 nanoparticles: an experimental and density functional study

2014 ◽  
Vol 2 (43) ◽  
pp. 9294-9302 ◽  
Author(s):  
Pawan Chetri ◽  
Biswajit Choudhury ◽  
Amarjyoti Choudhury
Keyword(s):  
Density Functional ◽  
Room Temperature ◽  
Sno2 Nanoparticles ◽  
Room Temperature Ferromagnetism ◽  
Functional Study ◽  
Theoretical Studies ◽  
Density Functional Study ◽  
Experimental And Theoretical Studies

Experimental and theoretical studies confirm that ferromagnetism in SnO2 appears owing to Sn4+ vacancies.

scholarly journals Effect of the number of nitrogen dopants on the electronic and magnetic properties of graphitic and pyridinic N-doped graphene – a density-functional study

RSC Advances ◽  
2021 ◽  
Vol 11 (30) ◽  
pp. 18371-18380
Author(s):  
Erik Bhekti Yutomo ◽  
Fatimah Arofiati Noor ◽  
Toto Winata
Keyword(s):  
Magnetic Properties ◽  
Density Functional ◽  
Functional Study ◽  
Density Functional Study ◽  
Electronic And Magnetic Properties ◽  
Doped Graphene ◽  
Dopant Atoms ◽  
Pyridinic N

The number of dopant atoms is a parameter that can effectively tune the electronic and magnetic properties of graphitic and pyridinic N-doped graphene.

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