Login
Login
切换导航
Home
Articles
Journals
Books
News
About
Services
Submit
Home
Journal
Articles
Journals A-Z
Browse Subjects
Biomedical & Life Sci.
Business & Economics
Chemistry & Materials Sci.
Computer Sci. & Commun.
Earth & Environmental Sci.
Engineering
Medicine & Healthcare
Physics & Mathematics
Social Sci. & Humanities
Browse Subjects
Biomedical & Life Sciences
Business & Economics
Chemistry & Materials Science
Computer Science & Communications
Earth & Environmental Sciences
Engineering
Medicine & Healthcare
Physics & Mathematics
Social Sciences & Humanities
Publish with us
Paper Submission
Information for Authors
Peer-Review Resources
Open Special Issues
Open Access Statement
Frequently Asked Questions
Publish with us
Paper Submission
Information for Authors
Peer-Review Resources
Open Special Issues
Open Access Statement
Frequently Asked Questions
Follow SCIRP
Contact us
+1 323-425-8868
customer@scirp.org
+86 18163351462(WhatsApp)
1655362766
Paper Publishing WeChat
Complete Matching
Editorial Board
Show/Hide Options
Show/Hide Options
All
Title
Abstract
Keywords
DOI
Author
Journal
Affiliation
ISSN
Subject
A First Principles Simulation Framework for the Interactions between a Si(001) Surface and a Scanning Probe
(Articles)
Dung Q. Ly
,
Charalampos Makatsoris
J. of Surface Engineered Materials and Advanced Technology
Vol.2 No.3A
,July 27, 2012
DOI:
10.4236/jsemat.2012.223030
4,503
Downloads
7,436
Views
Citations
This article belongs to the Special Issue on
Theoretical Study on the Optical and Electrical Properties of Al
x
Ga
1-
x
N Crystals
(Articles)
Xuewen Wang
,
Yuzhou Jing
,
Xinkang Zhu
,
Chan Liu
,
Jiangni Yun
,
Zhiyong Zhang
Journal of Modern Physics
Vol.4 No.3A
,March 29, 2013
DOI:
10.4236/jmp.2013.43A063
3,796
Downloads
6,194
Views
Citations
This article belongs to the Special Issue on
Density Functional Theory
Synthesis, Structural Characterization and DFT Studies of Silver(I) Complex Salt of Bis(4,5-dihydro-1
H
-benzo[g]indazole)
(Articles)
Tanyi Rogers Fomuta
,
Golngar Djimassingar
,
Jean Ngoune
,
Nana Odette Ngnabeuye
,
Jean Jacques Anguile
,
Justin Nenwa
Crystal Structure Theory and Applications
Vol.6 No.2
,May 28, 2017
DOI:
10.4236/csta.2017.62002
1,244
Downloads
2,395
Views
Citations
Synthesis, Rietveld Refinement and DFT Studies of Bis(4,5-dihydro-1
H
-benzo[g]indazole)silver(I) Hexafluorophosphate Complex Salt
(Articles)
Tanyi Rogers Fomuta
,
Jean Ngoune
,
Golngar Djimassingar
,
Tayo Alain Djampouo
,
Junior Ma Ntep Tobie Matemb
,
Jean Jacques Anguile
,
Justin Nenwa
Open Journal of Inorganic Chemistry
Vol.7 No.4
,October 30, 2017
DOI:
10.4236/ojic.2017.74007
1,096
Downloads
2,405
Views
Citations
Synthesis, Characterization and DFT Studies of Two Zinc(II) Complexes Based on 2-Isopropylimidazole
(Articles)
Jean Jacques Anguile
,
Odette Nana Ngnabeuye
,
Ndosiri Ndoye Bridget
,
Tanyi Rogers Fomuta
,
Alvine Loris Djoumbissie
,
Alain Charly Kuate Tagne
,
Jean Ngoune
Open Journal of Inorganic Chemistry
Vol.8 No.4
,October 30, 2018
DOI:
10.4236/ojic.2018.84009
937
Downloads
2,405
Views
Citations
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
1,026
Downloads
1,596
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
1,259
Downloads
2,590
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
905
Downloads
2,018
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
5,966
Downloads
9,011
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
4,093
Downloads
6,508
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
538
Downloads
1,605
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
7,555
Downloads
14,590
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
4,489
Downloads
6,949
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
5,786
Downloads
7,651
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
2,351
Downloads
3,346
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
1,835
Downloads
2,795
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
4,746
Downloads
6,324
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
956
Downloads
2,569
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
813
Downloads
1,832
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
4,374
Downloads
8,142
Views
Citations
<
1
2
3
...
>
Follow SCIRP
Contact us
+1 323-425-8868
customer@scirp.org
+86 18163351462(WhatsApp)
1655362766
Paper Publishing WeChat
Free SCIRP Newsletters
Home
Journals A-Z
Subject
Books
Sitemap
Contact Us
About SCIRP
Publication Fees
For Authors
Peer-Review Issues
Special Issues
News
Service
Manuscript Tracking System
Subscription
Translation & Proofreading
FAQ
Volume & Issue
Policies
Open Access
Publication Ethics
Preservation
Retraction
Privacy Policy
Copyright © 2006-2024 Scientific Research Publishing Inc. All Rights Reserved.
Top