Density Functional Theory DFT - Articles - Scientific Research Publishing

A Density Functional Theory Study of Methoxy and Atomic Hydrogen Chemisorption on Au(100) Surface (Articles)

M. N’dollo, P. S. Moussounda, T. Dintzer, F. Garin

Journal of Modern Physics Vol.4 No.3A, March 29, 2013

DOI: 10.4236/jmp.2013.43A057 5,917 Downloads 9,535 Views Citations
This article belongs to the Special Issue on Density Functional Theory
Elastic Stability and Multifunctional Properties of Wurtzite Aluminum Nitride from First Principles (Articles)

Mobisa Kemuma Deborah, Calford Odhiambo Otieno, Ketui Daniel, Otieno Ochieng Victor

Open Journal of Microphysics Vol.16 No.1, March 26, 2026

DOI: 10.4236/ojm.2026.161001 44 Downloads 324 Views Citations
Functionals and Functional Derivatives of Wave Functions and Densities (Articles)

A. Gonis

World Journal of Condensed Matter Physics Vol.4 No.3, August 29, 2014

DOI: 10.4236/wjcmp.2014.43022 4,500 Downloads 8,000 Views Citations
Research on the English Translation Methods of Government Texts from the Perspective of Functional Equivalence Theory (Articles)

Junye Li, Lijun Wang

Open Access Library Journal Vol.9 No.6, June 23, 2022

DOI: 10.4236/oalib.1108863 478 Downloads 3,490 Views Citations
The Translation Strategies of Chinese Classical Novels into English from the Perspective of the Functional Skopos Theory
—A Case Study of Journey to the West (Articles)

Fang Zhai, Ruihua Wang

Open Journal of Modern Linguistics Vol.16 No.1, January 26, 2026

DOI: 10.4236/ojml.2026.161003 129 Downloads 822 Views Citations
Density functional theory studies on the structure, vibrational spectra of three new tetrahalogenoferrate (III) complexes (Articles)

Shahriare Ghammamy, Kheyrollah Mehrani, Somayyeh Rostamzadehmansor, Hajar Sahebalzamani

Natural Science Vol.3 No.8, August 3, 2011

DOI: 10.4236/ns.2011.38091 5,687 Downloads 11,416 Views Citations
Variational Principle in the Quantum Statistical Theory (Articles)

Eduard A. Arinshteyn

Journal of Modern Physics Vol.5 No.14, August 22, 2014

DOI: 10.4236/jmp.2014.514128 2,851 Downloads 4,339 Views Citations
Effect of Hydrogen in Adsorption and Direct Dissociation of CO on Fe (100) Surface: A DFT Study (Articles)

Sebastián Amaya-Roncancio, Daniel Humberto Linares, Hélio Anderson Duarte, Germán Lener, Karim Sapag

American Journal of Analytical Chemistry Vol.6 No.1, January 9, 2015

DOI: 10.4236/ajac.2015.61004 4,246 Downloads 6,123 Views Citations
This article belongs to the Special Issue on Adsorption Science and Technology
Forecasting Density Function: Application in Finance (Articles)

Rituparna Sen, Changie Ma

Journal of Mathematical Finance Vol.5 No.5, November 26, 2015

DOI: 10.4236/jmf.2015.55037 4,969 Downloads 7,281 Views Citations
This article belongs to the Special Issue on Density Estimation in Finance
Development of the Orbital-Free Density Functional Approach: The Problem of Angles between Covalent Bonds (Articles)

Victor G. Zavodinsky, Olga A. Gorkusha

Modeling and Numerical Simulation of Material Science Vol.6 No.2, March 28, 2016

DOI: 10.4236/mnsms.2016.62002 2,683 Downloads 3,896 Views Citations
Synthesis and Evaluation of Corrosion Inhibiting Activity of New Molecular Hybrids Containing the Morpholine, 1,4-Naphthoquinone, 7-Chloroquinoline and 1,3,5-Triazine Cores (Articles)

Regina Westphal, Jorge Welton de Souza Pina, Juliana Panceri Franco, Josimar Ribeiro, Maicon Delarmelina, Rodolfo Goetze Fiorot, José Walkimar de Mesquita Carneiro, Sandro José Greco

Advances in Chemical Engineering and Science Vol.10 No.4, September 22, 2020

DOI: 10.4236/aces.2020.104024 859 Downloads 2,787 Views Citations
Density Functional Theory Studies on the Addition and Abstraction Reactions of OH Radical with Benzoate Anion (Articles)

Nobuaki Tanaka, Shigeo Itoh

Open Journal of Physical Chemistry Vol.3 No.1, February 19, 2013

DOI: 10.4236/ojpc.2013.31002 6,220 Downloads 10,543 Views Citations
Landau Theory of Fermi Liquid in a Relativistic Nonlinear (σ, ω) Model at Finite Temperature (Articles)

Schun T. Uechi, Hiroshi Uechi

Open Access Library Journal Vol.3 No.7, July 28, 2016

DOI: 10.4236/oalib.1102757 1,002 Downloads 2,513 Views Citations
Comparative Study of the Chemical Reactivity of Helical Peptide Models for Protein Glycation (Articles)

Juan Frau, Daniel Glossman-Mitnik

Computational Chemistry Vol.5 No.2, April 28, 2017

DOI: 10.4236/cc.2017.52006 1,442 Downloads 2,713 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 4,170 Downloads 8,847 Views Citations
Translation Methods of Chinese Prose from the Perspective of Functional Equivalence Theory—Taking the Translation of Wild Grass by Zhang Peiji as an Example (Articles)

Xiaopei Yang, Cun Gao

Open Access Library Journal Vol.7 No.11, November 12, 2020

DOI: 10.4236/oalib.1106956 2,581 Downloads 6,843 Views Citations
Translation Study on the Text of Exploring the Verdant Landscapes of the Tang Dynasty through Dunhuang Murals (Articles)

Miaotian Wen

Open Access Library Journal Vol.11 No.9, September 23, 2024

DOI: 10.4236/oalib.1111617 64 Downloads 509 Views Citations
Strategies for Accurate Translation of Geological Science and Technology Terminology from the Perspective of Functional Equivalence Theory (Articles)

Yiru Chen, Pengpeng Gao

Open Access Library Journal Vol.12 No.11, November 6, 2025

DOI: 10.4236/oalib.1114457 87 Downloads 444 Views Citations
Modeling of the Chemico-Physical Process of Protonation of Molecules Entailing Some Quantum Chemical Descriptors (Articles)

Sandip K. Rajak, Nazmul Islam, Dulal C. Ghosh

Journal of Quantum Information Science Vol.1 No.2, September 30, 2011

DOI: 10.4236/jqis.2011.12012 5,484 Downloads 11,142 Views Citations
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 793 Downloads 1,657 Views Citations

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