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Affiliation
ISSN
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A DFT/ECP-Small Basis Set Modelling of Cisplatin: Molecular Structure and Vibrational Spectrum
(Articles)
Nicolay I. Dodoff
Computational Molecular Bioscience
Vol.2 No.2
,June 29, 2012
DOI:
10.4236/cmb.2012.22004
6,508
Downloads
16,301
Views
Citations
Melting of Argon Cluster: Dependence of Caloric Curves on MD Simulation Parameters
(Articles)
Mohamed Tabti
,
Adil Eddahbi
,
Said Ouaskit
,
Lahcen Elarroum
World Journal of Condensed Matter Physics
Vol.2 No.3
,August 31, 2012
DOI:
10.4236/wjcmp.2012.23023
3,796
Downloads
6,761
Views
Citations
Synthesis, Structural Study and Spectroscopic Characterization of a Quinolin-8-Yloxy Derivative with Potential Biological Properties
(Articles)
Elida Romano
,
María V. Castillo
,
Jorgelina L. Pergomet
,
Juan Zinczuk
,
Silvia A. Brandán
Open Journal of Synthesis Theory and Applications
Vol.2 No.1
,January 28, 2013
DOI:
10.4236/ojsta.2013.21002
4,810
Downloads
8,755
Views
Citations
An Adjusted Model for Simple 1,2-Dyotropic Reactions.
Ab Initio
MO and VB Considerations
(Articles)
Henk M. Buck
Open Journal of Physical Chemistry
Vol.3 No.3
,August 6, 2013
DOI:
10.4236/ojpc.2013.33015
3,022
Downloads
5,490
Views
Citations
Construction of Periodic Solutions of One Class Nonautonomous Systems of Differential Equations
(Articles)
Alexander N. Pchelintsev
Journal of Applied Mathematics and Physics
Vol.1 No.3
,August 23, 2013
DOI:
10.4236/jamp.2013.13001
3,739
Downloads
8,033
Views
Citations
Estimation of the Temperature in the Weld Penetration Channel in Electron Beam Welding
(Articles)
D. N. Trushnikov
,
E. S. Salomatova
,
V. Ya. Belenkiy
Journal of Power and Energy Engineering
Vol.1 No.7
,November 28, 2013
DOI:
10.4236/jpee.2013.17009
3,401
Downloads
5,499
Views
Citations
Synthesis, Spectroscopic Investigations, Quantum Chemical Studies (
Ab-initio
& DFT) and Antimicrobial Activities of 3-(3-Chloro-4,5-dimethoxy-phenyl)-1-(4, 5-dimethoxy-2-methyl-Phenyl) prop-2-en-1-one
(Articles)
Urmila H. Patel
,
Sahaj A. Gandhi
,
Vijay M. Barot
,
Mitesh C. Patel
Crystal Structure Theory and Applications
Vol.2 No.4
,December 24, 2013
DOI:
10.4236/csta.2013.24023
5,076
Downloads
8,644
Views
Citations
Fine Structure Analysis of the Configuration System of V II. Part I: Even-Parity Levels
(Articles)
Safa Bouazza
,
Richard A. Holt
,
David S. Rosner
,
Nathan M. R. Armstrong
Journal of Modern Physics
Vol.5 No.7
,April 29, 2014
DOI:
10.4236/jmp.2014.57061
2,363
Downloads
3,506
Views
Citations
This article belongs to the Special Issue on
Surface Physics
Fine Structure Analysis of the Configuration System of V II. Part II: Odd-Parity Levels
(Articles)
Safa Bouazza
,
Richard A. Holt
,
David S. Rosner
,
Nathan M. R. Armstrong
Journal of Modern Physics
Vol.5 No.7
,April 29, 2014
DOI:
10.4236/jmp.2014.57062
2,299
Downloads
3,604
Views
Citations
This article belongs to the Special Issue on
Surface Physics
Theoretical Study of the Structure and Vibrational Spectrum of [Zn(2-Aminothiazole)
2
Cl
2
]
(Articles)
Rumyana Yankova
Open Access Library Journal
Vol.2 No.9
,September 10, 2015
DOI:
10.4236/oalib.1101864
632
Downloads
1,095
Views
Citations
[Azo-Hyd] Tautomerism and Structure of Selected Metal Complex Dyes AM1 and ZINDO/1 Methods
(Articles)
Krzysztof Wojciechowski
,
Lucjan Szuster
Computational Chemistry
Vol.4 No.4
,October 19, 2016
DOI:
10.4236/cc.2016.44010
2,107
Downloads
3,746
Views
Citations
Reactivity of N-Methylidenemalonates of 3-Arylaminoindoles and p-Dimethylamino-N-Phenylaniline in the Course of Their Analysis by Electrospray Ionization Mass Spectrometry
(Articles)
Yuri S. Nekrasov
,
Nikolai S. Ikonnikov
,
Yuri A. Borisov
,
Sergey S. Kiselev
,
Albert G. Kornienko
,
Valeriya S. Velezheva
,
Yury I. Lyakhovetsky
Int'l J. of Analytical Mass Spectrometry and Chromatography
Vol.5 No.1
,February 13, 2017
DOI:
10.4236/ijamsc.2017.51001
1,862
Downloads
3,068
Views
Citations
Ab-Initio
Computations of Electronic, Transport, and Structural Properties of
zinc-blende
Beryllium Selenide (
zb
-BeSe)
(Articles)
Richard Inakpenu
,
Cheick Bamba
,
Ifeanyi H. Nwigboji
,
Lashounda Franklin
,
Yuriy Malozovsky
,
Guang-Lin Zhao
,
Diola Bagayoko
Journal of Modern Physics
Vol.8 No.4
,March 20, 2017
DOI:
10.4236/jmp.2017.84037
1,565
Downloads
2,473
Views
Citations
This article belongs to the Special Issue on
Density Functional Theory
Theoretical and Experimental Study of Reaction of Transesterification of Vegetable Oils in an Alcohol Environment in the SbCF and SCF Conditions with the Ultrasonic Emulsification of Reaction Mixture and the Use of Heterogeneous Catalysts
(Articles)
Farid Mukhamedovich Gumerov
,
Rustem Aituganovich Usmanov
,
Sergei Valerevich Mazanov
,
Asiya Radifovna Gabitova
,
Alexandre Ivanovich Kourdiyukov
,
Zufar Ibragimovich Zaripov
Int'l J. of Analytical Mass Spectrometry and Chromatography
Vol.5 No.2
,June 30, 2017
DOI:
10.4236/ijamsc.2017.52003
1,217
Downloads
2,097
Views
Citations
This article belongs to the Special Issue on
Supercritical Fluids: Supercritical Fluid Extraction (SFE) and Supercritical Fluid Chromatography (SFC)
Gas Phase Activation of Methane Molecule with Lead Benzene Dication Complex Ion, [Pb(Benzene)
2
]
2+
(Articles)
Joseph K. Koka
Materials Sciences and Applications
Vol.10 No.2
,January 29, 2019
DOI:
10.4236/msa.2019.102009
601
Downloads
1,151
Views
Citations
Circular Scale of Time as a Guide for the Schrödinger Perturbation Process of a Quantum-Mechanical System
(Articles)
Stanisław Olszewski
World Journal of Mechanics
Vol.9 No.5
,May 16, 2019
DOI:
10.4236/wjm.2019.95009
630
Downloads
1,345
Views
Citations
A Thematic Analysis on Vedic Mathematics and Its Importance
(Articles)
Sher Singh Raikhola
,
Dinesh Panthi
,
Eka Ratna Acharya
,
Kanhaiya Jha
Open Access Library Journal
Vol.7 No.8
,August 28, 2020
DOI:
10.4236/oalib.1106665
1,244
Downloads
5,759
Views
Citations
Key Role of Some Specific Occupied Molecular Orbitals of Short Chain n-Alkanes in Their Surface Tension and Reaction Rate Constants with Hydroxyl Radicals: DFT Study
(Articles)
Mikhail Yu Gorbachev
,
Natalia N. Gorinchoy
,
Ion Arsene
International Journal of Organic Chemistry
Vol.11 No.1
,January 29, 2021
DOI:
10.4236/ijoc.2021.111001
444
Downloads
983
Views
Citations
Multi-Energy Gamma-Ray Attenuations for Non-Destructive Detection of Hazardous Materials
(Articles)
Kaylyn Olshanoski
,
Chary Rangacharyulu
Journal of Modern Physics
Vol.13 No.1
,January 26, 2022
DOI:
10.4236/jmp.2022.131005
183
Downloads
825
Views
Citations
Molecular Orbital Nature of Solubility of Shot Chain n-Alkanes in Water and Their Reaction Rate Constants with Nitronium Cations: A DFT Study
(Articles)
Mikhail Yu. Gorbachev
,
Natalia N. Gorinchoy
International Journal of Organic Chemistry
Vol.12 No.2
,June 9, 2022
DOI:
10.4236/ijoc.2022.122008
158
Downloads
610
Views
Citations
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