Functional Equivalence Theory - Articles - Scientific Research Publishing

Combining Experimental and Quantum Chemical Study of 2-(5-Nitro-1,3-Dihydro Benzimidazol-2-Ylidene)-3-Oxo-3-(2-Oxo-2H-Chromen-3-yl) Propanenitrile as Copper Corrosion Inhibitor in Nitric Acid Solution (Articles)

Mougo André Tigori, Aboudramane Koné, Bamba Souleymane, Doumadé Zon, Drissa Sissouma, Paulin Marius Niamien

Open Journal of Physical Chemistry Vol.12 No.4，November 29, 2022

DOI: 10.4236/ojpc.2022.124004 158 Downloads 830 Views Citations
Insight of Natural Compounds Halimane Diterpenoids against Mycobacterium tuberculosis: Virtual Screening, DFT, Drug-Likeness, and Molecular Dynamics Approach (Articles)

Laurent Gael Eyia Andiga, Boris Davy Bekono, Désiré Mama Bikele, Pie Pascal Onguéné Amoa, Luc Calvin Owono Owono, Luc Léonard Mbaze Meva’a

Computational Molecular Bioscience Vol.14 No.2，May 7, 2024

DOI: 10.4236/cmb.2024.142003 116 Downloads 427 Views Citations
Study the Structural, Electronic, Optical Properties of CZTS Compound after Doping Ba at Zn Site and Si at Sn Site Using Density Functional Theory (DFT) (Articles)

Fatema Najrin, Rabeya Bakar Sarna, Sayedul Hasan, Shariful Islam, Budrun Neher, Md. Mahbubur Rahman Bhuiyan, Farid Ahmed

Materials Sciences and Applications Vol.15 No.9，September 11, 2024

DOI: 10.4236/msa.2024.159021 82 Downloads 514 Views Citations
The Number of Matching Equivalent for the Union Graph of Vertices and Cycles (Articles)

Xiaoling Wang

Applied Mathematics Vol.12 No.6，June 24, 2021

DOI: 10.4236/am.2021.126032 276 Downloads 836 Views Citations
Surface Photografting of Novel Sulfobetaine Copolymers on Silica (Articles)

Abhishek Kumar, Nazia Tarannum, Meenakshi Singh

Materials Sciences and Applications Vol.3 No.7，July 19, 2012

DOI: 10.4236/msa.2012.37066 4,876 Downloads 7,482 Views Citations
Investigation of electronic structure of Nd₂O₃: Experiment and theory (Articles)

Fareed Majeed Mohammad, Abdulhadi Mirdan Ghaleb, Sahariya Jagrati, Babu Lal Ahuja, Kailash Chandra Bhamu

Natural Science Vol.4 No.10，October 31, 2012

DOI: 10.4236/ns.2012.410106 4,083 Downloads 6,729 Views Citations
Is Alzheimer’s Disease an Adaptability Disorder? What Role Does Happiness Have in Treatment, Management and Prevention (Articles)

John B. Myers

World Journal of Neuroscience Vol.5 No.3，June 2, 2015

DOI: 10.4236/wjns.2015.53020 3,475 Downloads 4,324 Views Citations
Erratum to “Is Alzheimer’s Disease an Adaptability Disorder? What Role Does Happiness Have in Treatment, Management and Prevention” [World Journal of Neuroscience 5 (2015) 180-188] (Articles)

John B. Myers

World Journal of Neuroscience Vol.5 No.4，July 31, 2015

DOI: 10.4236/wjns.2015.54027 6,275 Downloads 7,549 Views Citations
Impulsive Predator-Prey Dynamic Systems with Beddington-DeAngelis Type Functional Response on the Unification of Discrete and Continuous Systems (Articles)

Ayşe Feza Güvenilir, Billur Kaymakçalan, Neslihan Nesliye Pelen

Applied Mathematics Vol.6 No.9，August 28, 2015

DOI: 10.4236/am.2015.69147 2,958 Downloads 4,107 Views Citations
A Study by Ab-Initio Calculation of Structural and Electronic Properties of Semiconductor Nanostructures Based on ZnSe (Articles)

A. Rachidi, E. H. Atmani, N. Fazouan, M. Boujnah

Materials Sciences and Applications Vol.7 No.9，September 29, 2016

DOI: 10.4236/msa.2016.79047 1,784 Downloads 4,051 Views Citations
This article belongs to the Special Issue on Advanced Functional Materials Research
The Chiral Dirac-Hartree-Fock Approximation in QHD with Scalar Vertex Corrections (Articles)

Hiroshi Uechi

Open Access Library Journal Vol.5 No.7，July 24, 2018

DOI: 10.4236/oalib.1104739 451 Downloads 1,236 Views Citations
Investigation of Structural and Electronic Properties of [Tris(Benzene-1,2-Dithiolato)M]^3- (M = V, Cr, Mn, Fe and Co) Complexes: A Spectroscopic and Density Functional Theoretical Study (Articles)

Mohammad A. Matin, Md. Abdur Rahman

Advances in Chemical Engineering and Science Vol.9 No.4，October 9, 2019

DOI: 10.4236/aces.2019.94023 713 Downloads 2,152 Views Citations
Electronic Absorption Spectra and Third-Order Nonlinear Optical Property of Dinaphtho[2,3-b:2’,3’-d]Thiophene-5,7,12,13- Tetraone (DNTTRA) and Its Phenyldiazenyl Derivatives: DFT Calculations (Articles)

Ziran Chen, Yujin Zhang, Zhanrong He, Yonghua Guan, Yuan Li, Hongping Li

Computational Chemistry Vol.8 No.4，October 30, 2020

DOI: 10.4236/cc.2020.84005 489 Downloads 1,420 Views Citations
DFT Investigation of the Hydrogen Adsorption on Graphene and Graphene Sheet Doped with Osmium and Tungsten (Articles)

Balqees Suliman Alshareef

Open Journal of Physical Chemistry Vol.10 No.4，November 6, 2020

DOI: 10.4236/ojpc.2020.104012 672 Downloads 2,049 Views Citations
Redshift of Excitation Wavelength Caused by the Concentration of L-Tryptophan in Water: A Theoretical and Experimental Study (Articles)

Diana Milena Uriza-Prias, Antonio Méndez-Blas, Juan Francisco Rivas-Silva

Open Journal of Physical Chemistry Vol.11 No.2，May 26, 2021

DOI: 10.4236/ojpc.2021.112005 423 Downloads 2,204 Views Citations
Investigation of the Antioxidant and UV Absorption Properties of 2-(2’-hydroxy-5’-methylphenyl)-benzotriazole and Its Ortho-Substituted Derivatives via DFT/TD-DFT (Articles)

Numbonui Stanley Tasheh, Aymard Didier Tamafo Fouegue, Julius Numbonui Ghogomu

Computational Chemistry Vol.9 No.3，July 14, 2021

DOI: 10.4236/cc.2021.93010 354 Downloads 1,738 Views Citations
DNA Base Pairs Sensors: DFT, QTAIM and NCI-RDG Study (Articles)

Nour Elyakine Amraoui, Dalila Hammoutène

Computational Chemistry Vol.12 No.4，October 31, 2024

DOI: 10.4236/cc.2024.124004 66 Downloads 374 Views Citations
Are Government Bonds Net Wealth? Some Empirical Evidence (Articles)

Tito Belchior Silva Moreira, Geraldo da Silva e Souza, Fernando Antônio Ribeiro Soares

Modern Economy Vol.2 No.3，July 28, 2011

DOI: 10.4236/me.2011.23045 6,211 Downloads 11,118 Views Citations
Equivalence Problem of the Painlevé Equations (Articles)

Sopita Khamrod

Advances in Pure Mathematics Vol.3 No.2，March 19, 2013

DOI: 10.4236/apm.2013.32042 3,116 Downloads 5,901 Views Citations
Are Newer-Generation Drug-Eluting Stents More Effective in Women than Early-Generation Ones? (Articles)

Andrea Messori, Valeria Fadda, Dario Maratea, Sabrina Trippoli

World Journal of Cardiovascular Diseases Vol.4 No.4，April 21, 2014

DOI: 10.4236/wjcd.2014.44021 4,295 Downloads 5,469 Views Citations

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