Functional Equivalence Theory - Articles - Scientific Research Publishing

First-Principles Study on Cation-Antisite Defects of Stannate and Titanate Pyrochlores (Articles)

Lianju Chen, Xue Su, Yuhong Li

Open Access Library Journal Vol.1 No.3, June 6, 2014

DOI: 10.4236/oalib.1100516 1,380 Downloads 2,520 Views Citations
Error Analysis of Business English Translation Based upon Functional Theory (Articles)

Lili Zhang

Advances in Literary Study Vol.4 No.3, July 19, 2016

DOI: 10.4236/als.2016.43007 4,200 Downloads 8,927 Views Citations
Simple Model of Transformation of a Crystal Structures (Articles)

B. I. Lev

Journal of Modern Physics Vol.7 No.16, December 26, 2016

DOI: 10.4236/jmp.2016.716205 1,504 Downloads 2,614 Views Citations
Electronic Properties of NbSe₂ over Graphene: A Meticulous Theoretical Analysis (Articles)

Donald Homero Galvan, Joel Antúnez-García, Sergio Fuentes Moyado

Open Access Library Journal Vol.4 No.5, May 11, 2017

DOI: 10.4236/oalib.1103512 1,010 Downloads 2,220 Views Citations
Accurate Electronic, Transport, and Related Properties of Wurtzite Beryllium Oxide (w-BeO) (Articles)

Cheick Oumar Bamba, Richard Inakpenu, Yacouba I. Diakite, Lashounda Franklin, Yuriy Malozovsky, Anthony D. Stewart, Diola Bagayoko

Journal of Modern Physics Vol.8 No.12, November 17, 2017

DOI: 10.4236/jmp.2017.812116 1,325 Downloads 2,941 Views Citations
Conversion of 3,4-Dihydroxypyrrolidine-2,5-Dione to Maleimide through Tosylation and Mechanism Study by DFT (Articles)

Maocai Yan, Zhen Zhang, Jinhui Zhou, Wei Li, Shuai Fan, Zhaoyong Yang

Computational Chemistry Vol.6 No.3, July 23, 2018

DOI: 10.4236/cc.2018.63004 1,435 Downloads 2,987 Views Citations
Accurate, First-Principle Study of Electronic and Related Properties of the Ground State of Li₂Se (Articles)

Abdoulaye Goita, Feng Gao, Ifeanyi H. Nwigboji, Yuriy Malozovsky, Lashounda Franklin, Diola Bagayoko

Journal of Modern Physics Vol.10 No.8, July 9, 2019

DOI: 10.4236/jmp.2019.108060 892 Downloads 1,943 Views Citations
This article belongs to the Special Issue on Density Functional Theory
Imaginary Time Density Functional Calculation of Ground States of Atoms Using CWDVR Approach (Articles)

Naranchimeg Davgiikhorol, Munkhsaikhan Gonchigsuren, Khenmedekh Lochin, Sukh Ochir, Tsogbadrakh Namsrai

Journal of Modern Physics Vol.10 No.9, August 6, 2019

DOI: 10.4236/jmp.2019.109073 981 Downloads 2,252 Views Citations
Computational Analysis of a Series of Chlorinated Chalcone Derivatives (Articles)

Bradley O. Ashburn

Computational Chemistry Vol.7 No.4, October 16, 2019

DOI: 10.4236/cc.2019.74008 1,026 Downloads 3,015 Views Citations
Inhibition Performance of Some Sulfonylurea on Copper Corrosion in Nitric Acid Solution Evaluated Theoretically by DFT Calculations (Articles)

Mougo André Tigori, Amadou Kouyaté, Victorien Kouakou, Paulin Marius Niamien, Albert Trokourey

Open Journal of Physical Chemistry Vol.10 No.3, August 3, 2020

DOI: 10.4236/ojpc.2020.103008 848 Downloads 2,280 Views Citations
Hydrogen Adsorption Mechanism of SiC Nanocones (Articles)

M. A. Al-Khateeb, A. A. El-Barbary

Graphene Vol.9 No.1, January 31, 2020

DOI: 10.4236/graphene.2020.91001 789 Downloads 2,113 Views Citations
Effect of Exchange-Correlation Functional on the Structural, Mechanical, and Optoelectronic Properties of Orthorhombic RbSrBr₃ Perovskite (Articles)

Fatema Najrin, Rabeya Bakar Sarna, Md. Alamin Sarker, Budrun Neher, Md. Mahbubur Rahman Bhuiyan, Farid Ahmed

Materials Sciences and Applications Vol.15 No.6, June 28, 2024

DOI: 10.4236/msa.2024.156010 155 Downloads 864 Views Citations
First-Principles Calculations on Novel Rb-Based Halide Double Perovskites Alloys for Spintronics and Optoelectronic Applications (Articles)

Saadi Berri, Nadir Bouarissa

Optics and Photonics Journal Vol.14 No.1, January 31, 2024

DOI: 10.4236/opj.2024.141001 246 Downloads 1,199 Views Citations
First-Principles Investigation of Substitutional Boron and Phosphorus Doping in Crystalline Silicon (Articles)

Tresor Balembo Matindi, Renedi Ruharura Mapendo, Aurelia Muninga Mujinga, Christ Mwana Kabamba

Journal of Materials Science and Chemical Engineering Vol.14 No.3, March 10, 2026

DOI: 10.4236/msce.2026.143003 82 Downloads 413 Views Citations
Corrosion Inhibition of Aluminium in Gas and Acid Media by Some Chalcone-Based N-(3-Aminopropyl)Imidazoles: TD-DFT-Based FMO, Conceptual DFT, QTAIM and EDA Studies (Articles)

Fritzgerald Kogge Bine, Stanley Numbonui Tasheh, Nyiang Kennet Nkungli

Computational Chemistry Vol.9 No.1, January 5, 2021

DOI: 10.4236/cc.2021.91003 747 Downloads 2,343 Views Citations
Method of Estimation of Chemical Compounds of a Solution by Analysis of Video Images of Titration from a Semi-Automatic Approach (Articles)

Marcelin Sandje, Sie Ouattara, Diako Doffou Jerome, Alain Clément

Open Journal of Applied Sciences Vol.12 No.6, June 30, 2022

DOI: 10.4236/ojapps.2022.126073 305 Downloads 2,132 Views Citations
Scalar Equivalence in Self-Rated Depressive Symptomatology as Measured by the Beck Depression Inventory-II: Do Racial and Gender Differences in College Students Exist? (Articles)

Lisa M. Hooper, Lixin Qu, Cindy A. Crusto, Lauren E. Huffman

Psychology Vol.3 No.9A, September 25, 2012

DOI: 10.4236/psych.2012.329116 7,004 Downloads 12,061 Views Citations
This article belongs to the Special Issue on Depression
Galileo vs. Aristotle, Principles of Equivalence and the Gravitational Acceleration of Atoms according to General Relativity (Articles)

Charles H. McGruder III

Journal of Modern Physics Vol.16 No.7, July 30, 2025

DOI: 10.4236/jmp.2025.167053 160 Downloads 804 Views Citations
First Principle Study of the Structural and Piezoelectric Properties of Perovskite ZrTi(PbO₃)₂ Materials for Naval SONAR (Articles)

Owolabi Joshua Adeyemi, Gidado Mohammed Mawashi, Alhassan Shuaibu, Bamikole Johnson Akinade, Ugbe Raphael Ushiekpan

Journal of Applied Mathematics and Physics Vol.7 No.2, February 14, 2019

DOI: 10.4236/jamp.2019.72022 2,056 Downloads 3,775 Views Citations
Behavioral-Cognitive Inhibition Theory: Conceptualization of Posttraumatic Stress Disorder and Other Psychopathology Disorders (Articles)

Nenad Paunovic

Psychology Vol.1 No.5, December 28, 2010

DOI: 10.4236/psych.2010.15044 11,062 Downloads 30,406 Views Citations

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