Experimental and first-principles study of guanine adsorption on ZnO clusters

V. L. Chandraboss; B. Karthikeyan; S. Senthilvelan

doi:10.1039/c4cp03274h

Experimental and first-principles study of guanine adsorption on ZnO clusters

Physical Chemistry Chemical Physics ◽

10.1039/c4cp03274h ◽

2014 ◽

Vol 16 (42) ◽

pp. 23461-23475 ◽

Cited By ~ 25

Author(s):

V. L. Chandraboss ◽

B. Karthikeyan ◽

S. Senthilvelan

Keyword(s):

Electronic Structure ◽

First Principles ◽

First Principles Study ◽

Zno Clusters

Electronic structure for interaction of guanine with Zn2O2 cluster and the most preferred N1-site to form a stable G–Zn2O2 model.

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Strain effect on electronic structure and thermoelectric properties of orthorhombic SnSe: A first principles study

AIP Advances ◽

10.1063/1.4936636 ◽

2015 ◽

Vol 5 (11) ◽

pp. 117147 ◽

Cited By ~ 22

Author(s):

Do Duc Cuong ◽

S. H. Rhim ◽

Joo-Hyong Lee ◽

Soon Cheol Hong

Keyword(s):

Electronic Structure ◽

Thermoelectric Properties ◽

First Principles ◽

Strain Effect ◽

First Principles Study

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First-principles study of (Ti5−xMgx)Si3 phases with the hexagonal D88 structure: Elastic properties and electronic structure

Computational Materials Science ◽

10.1016/j.commatsci.2011.10.042 ◽

2012 ◽

Vol 54 ◽

pp. 287-292 ◽

Cited By ~ 11

Author(s):

Xiao-Jun Chen ◽

Meng-Xue Zeng ◽

Ren-Nian Wang ◽

Zhou-Sheng Mo ◽

Bi-Yu Tang ◽

...

Keyword(s):

Electronic Structure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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First-principles study of electronic structure, sodium diffusion, and (de)intercalation in NASICON NaMR(MoO4)3 (M = Mg, Ni; R = Cr, Fe)

Ionics ◽

10.1007/s11581-021-04133-7 ◽

2021 ◽

Author(s):

Alexander Serdtsev ◽

Irina Kotova ◽

Nadezhda Medvedeva

Keyword(s):

Electronic Structure ◽

First Principles ◽

First Principles Study ◽

Sodium Diffusion

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First principles study on electronic structure and elastic properties of LaCd and LaHg

10.1063/1.4872850 ◽

2014 ◽

Author(s):

Hansa Devi ◽

Gitanjali Pagare ◽

S. S. Chouhan ◽

Sankar P. Sanyal

Keyword(s):

Electronic Structure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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First-principles study of electronic structure of deformed carbon nanotubes

Science and Technology of Advanced Materials ◽

10.1016/j.stam.2006.12.008 ◽

2007 ◽

Vol 8 (3) ◽

pp. 200-203 ◽

Cited By ~ 6

Author(s):

Kazuchika Iwami ◽

Hidekazu Goto ◽

Kikuji Hirose ◽

Tomoya Ono

Keyword(s):

Carbon Nanotubes ◽

Electronic Structure ◽

First Principles ◽

First Principles Study

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First-principles study of the thermodynamic properties and electronic structure of compounds from Hf–Ni phase system

Computational Materials Science ◽

10.1016/j.commatsci.2010.04.019 ◽

2010 ◽

Vol 49 (1) ◽

pp. 55-59 ◽

Cited By ~ 6

Author(s):

Jana Radaković ◽

Katarina Ćirić ◽

Jelena Belošević-Čavor ◽

Vasil Koteski

Keyword(s):

Electronic Structure ◽

Thermodynamic Properties ◽

First Principles ◽

Phase System ◽

First Principles Study

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First-principles study of the electronic structure of NaTaO3

Solid State Communications ◽

10.1016/s0038-1098(01)00353-2 ◽

2001 ◽

Vol 120 (4) ◽

pp. 137-140 ◽

Cited By ~ 21

Author(s):

Y.X. Wang ◽

W.L. Zhong ◽

C.L. Wang ◽

P.L. Zhang

Keyword(s):

Electronic Structure ◽

First Principles ◽

First Principles Study

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First-principles study on the electronic structure and optical properties of Mn-doped NaNbO3

2015 Symposium on Piezoelectricity, Acoustic Waves, and Device Applications (SPAWDA) ◽

10.1109/spawda.2015.7364445 ◽

2015 ◽

Author(s):

Shu-lan Zhou ◽

Xiao-dong Han ◽

Xian Zhao ◽

Xiang-ping Jiang

Keyword(s):

Optical Properties ◽

Electronic Structure ◽

First Principles ◽

First Principles Study ◽

Mn Doped

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First principles study on the electronic structure properties of Keggin polyoxometalates on Carbon substrates for solid-state devices

Theoretical Chemistry Accounts ◽

10.1007/s00214-017-2049-3 ◽

2017 ◽

Vol 136 (2) ◽

Cited By ~ 10

Author(s):

Jesús Muñiz ◽

Christian Celaya ◽

Ana Mejía-Ozuna ◽

Ana Karina Cuentas-Gallegos ◽

L. M. Mejía-Mendoza ◽

...

Keyword(s):

Electronic Structure ◽

Solid State ◽

First Principles ◽

First Principles Study ◽

Solid State Devices ◽

Carbon Substrates ◽

Structure Properties

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First-principles study of electronic structure and ground-state properties of alkali-metal sulfides – Li2S, Na2S, K2S and Rb2S

physica status solidi (b) ◽

10.1002/pssb.200642506 ◽

2007 ◽

Vol 244 (4) ◽

pp. 1337-1346 ◽

Cited By ~ 44

Author(s):

R. D. Eithiraj ◽

G. Jaiganesh ◽

G. Kalpana ◽

M. Rajagopalan

Keyword(s):

Electronic Structure ◽

Alkali Metal ◽

Ground State ◽

First Principles ◽

Metal Sulfides ◽

First Principles Study ◽

Ground State Properties

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