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Designing Sensors Using Nano-Junctions
(Articles)
Vijay K. Lamba
,
O. P. Garg
Journal of Applied Mathematics and Physics
Vol.4 No.12
,December 29, 2016
DOI:
10.4236/jamp.2016.412217
1,065
Downloads
1,664
Views
Citations
Structural and Spectral (IR, NMR and UV/Visible) Properties of Newly Designed Boronic Acid Derivatives Containing DO3A Sensitive to Uranyl Ion: A DFT and TD-DFT Study
(Articles)
Kübra Sarikavak
,
Fatma Sevin
Computational Chemistry
Vol.5 No.4
,October 16, 2017
DOI:
10.4236/cc.2017.54012
1,324
Downloads
2,644
Views
Citations
Quantum Chemical Studies of Some Hydrazone Derivatives
(Articles)
Mahougbe T. A. Kpota Houngue
,
Maurice N’bouke
,
Bardieu Atchade
,
Rodrigue Chabi Doco
,
Urbain A. Kuevi
,
Gaston A. Kpotin
,
Salomé D. S. Kpoviessi
,
Yacole G. S. Atohoun
,
Michael Badawi
,
Jean-Baptiste Mensah
Computational Chemistry
Vol.6 No.1
,February 28, 2018
DOI:
10.4236/cc.2018.61001
949
Downloads
2,140
Views
Citations
Theoretical Study of Dibenzothiophene Based Electron Transport Materials
(Articles)
Asanga B. Padmaperuma
Advances in Materials Physics and Chemistry
Vol.2 No.4
,December 31, 2012
DOI:
10.4236/ampc.2012.24033
6,045
Downloads
8,886
Views
Citations
DFT and TD-DFT Study of Bis[2-(5-Amino-[1,3,4]-Oxadiazol-2-yl) Phenol](Diaqua)M(II) Complexes [M = Cu, Ni and Zn]: Electronic Structures, Properties and Analyses
(Articles)
Nyiang Kennet Nkungli
,
Julius Numbonui Ghogomu
,
Ludovid Ngouo Nogheu
,
Shridhar Ramachandra Gadre
Computational Chemistry
Vol.3 No.3
,October 28, 2015
DOI:
10.4236/cc.2015.33005
4,171
Downloads
6,319
Views
Citations
Molecular Docking and Conceptual DFT-Based Study of Some Potential SARS-CoV-2 Inhibitors
(Articles)
Norma Flores-Holguín
,
Daniel Glossman-Mitnik
Computational Molecular Bioscience
Vol.10 No.4
,December 31, 2020
DOI:
10.4236/cmb.2020.104008
606
Downloads
1,728
Views
Citations
Structural and Electronic Properties of Impurities on Boron Nitride Nanotube
(Articles)
Gabrielle P. Soares
,
Silvete Guerini
Journal of Modern Physics
Vol.2 No.8
,August 12, 2011
DOI:
10.4236/jmp.2011.28102
7,646
Downloads
14,211
Views
Citations
Ab-Initio
Structural Study of SrMoO
3
Perovskite
(Articles)
Avinash Daga
,
Smita Sharma
Journal of Modern Physics
Vol.3 No.12
,December 21, 2012
DOI:
10.4236/jmp.2012.312238
4,544
Downloads
7,041
Views
Citations
Effect of Tubular Chiralities and Diameters of Single Carbon Nanotubes on Gas Sensing Behavior: A DFT Analysis
(Articles)
A. A. EL-Barbary
,
Kh. M. Eid
,
M. A. Kamel
,
H. M. Osman
,
G. H. G. H. Ismail
J. of Surface Engineered Materials and Advanced Technology
Vol.4 No.2
,April 18, 2014
DOI:
10.4236/jsemat.2014.42010
5,857
Downloads
7,659
Views
Citations
On DFT Molecular Simulation for Non-Adaptive Kernel Approximation
(Articles)
Maharavo Randrianarivony
Advances in Materials Physics and Chemistry
Vol.4 No.6
,June 18, 2014
DOI:
10.4236/ampc.2014.46013
2,389
Downloads
3,426
Views
Citations
Erratum to “On DFT Molecular Simulation for Non-Adaptive Kernel Approximation” [Advances in Materials Physics and Chemistry Vol. 4 No. 6 (June 2014) 105-115]
(Articles)
Maharavo Randrianarivony
Advances in Materials Physics and Chemistry
Vol.5 No.3
,March 6, 2015
DOI:
10.4236/ampc.2015.53012
1,868
Downloads
2,893
Views
Citations
Adsorption of CO, CO
2
, NO and NO
2
on Boron Nitride Nanotubes: DFT Study
(Articles)
A. A. El-Barbary
,
Kh. M. Eid
,
M. A. Kamel
,
H. O. Taha
,
G. H. Ismail
J. of Surface Engineered Materials and Advanced Technology
Vol.5 No.3
,July 8, 2015
DOI:
10.4236/jsemat.2015.53017
4,829
Downloads
6,321
Views
Citations
A Generation Method of Dithering Signal Based on DFT
(Articles)
Changqing Ye
,
Xingzhong Xiong
Int'l J. of Communications, Network and System Sciences
Vol.10 No.8B
,August 14, 2017
DOI:
10.4236/ijcns.2017.108B032
1,004
Downloads
2,620
Views
Citations
Thermal Decomposition of Diphenyl Tetroxane in Chlorobenzene Solution
(Articles)
Alexander G. Bordon
,
Andrea N. Pila
,
Mariela I. Profeta
,
María J. Jorge
,
Lilian C. Jorge
,
Jorge M. Romero
,
Nelly L. Jorge
International Journal of Organic Chemistry
Vol.9 No.1
,January 14, 2019
DOI:
10.4236/ijoc.2019.91001
857
Downloads
1,917
Views
Citations
Research on Access Network Intrusion Detection System Based on DMT Technology
(Articles)
Lingxi Wu
,
Jie Zhan
,
Qiange He
,
Shuiyan He
Int'l J. of Communications, Network and System Sciences
Vol.3 No.5
,May 31, 2010
DOI:
10.4236/ijcns.2010.35064
4,413
Downloads
8,222
Views
Citations
Solvatochromism and Molecular Selectivity of C-(4-chlorophenyl)-N-phenylnitrone: A Photophysical Study
(Articles)
Sneha Salampuria
,
Tandrima Chaudhuri
,
Manas Banerjee
Optics and Photonics Journal
Vol.2 No.1
,March 28, 2012
DOI:
10.4236/opj.2012.21005
4,259
Downloads
7,787
Views
Citations
Effect of Monovacancy Defects on Adsorbing of CO, CO
2
, NO and NO
2
on Carbon Nanotubes: First Principle Calculations
(Articles)
Ahlam A. EL-Barbary
,
Gehan H. Ismail
,
Afaf M. Babeer
J. of Surface Engineered Materials and Advanced Technology
Vol.3 No.4
,October 21, 2013
DOI:
10.4236/jsemat.2013.34039
3,642
Downloads
5,271
Views
Citations
Theoretical Study of 5-HTP. Potential New Drug Resulting from the Complexation of 5-HTP with ATP
(Articles)
Josette Weinberg
,
Dan A. Lerner
Computational Chemistry
Vol.1 No.1
,October 29, 2013
DOI:
10.4236/cc.2013.11001
6,063
Downloads
16,239
Views
Citations
DFT Study of Monochlorinated Pyrene Compounds
(Articles)
Ehab AlShamaileh
Computational Chemistry
Vol.2 No.3
,July 28, 2014
DOI:
10.4236/cc.2014.23006
5,449
Downloads
7,465
Views
Citations
Quantum-Chemical Description of Influence of the R-Groups on Formation of Peptide Bond
(Articles)
Jumber Kereselidze
,
Marine Kvaraia
,
George Mikuchadze
Computational Molecular Bioscience
Vol.4 No.2
,September 17, 2014
DOI:
10.4236/cmb.2014.42004
3,547
Downloads
4,515
Views
Citations
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