DFT Studies - Articles - Scientific Research Publishing

Collaborative Learning in Maternity and Child Health Clinics (Articles)

Tiina Tervaskanto-Mäentausta, Marja Ojaniemi, Leila Mikkilä, Leila Laitila-Özcok, M. Niinimäki, Tanja Nordström, Anja Taanila

Creative Education Vol.5 No.20, November 19, 2014

DOI: 10.4236/ce.2014.520201 3,476 Downloads 4,914 Views Citations
This article belongs to the Special Issue on Collaborative and Group Learning
Economic Reforms and an African Market Economy (Articles)

Oluremi Ogun

Open Access Library Journal Vol.5 No.1, January 15, 2018

DOI: 10.4236/oalib.1104242 591 Downloads 3,210 Views Citations
Assessing Likelihood of Having False Positives Caused by Population Stratification (Articles)

Renfang Jiang, Jianping Dong

Open Journal of Genetics Vol.9 No.1, March 28, 2019

DOI: 10.4236/ojgen.2019.91002 1,043 Downloads 2,190 Views Citations
Synthesis and Controllable Growth Dynamics of Third Order Nonlinear Optical Material of 2-Amino-4-Methylpyridinium 2-Chloro 4-Nitro Benzoate Electro-Mechanical Investigation and Device Fabrication (Articles)

Kuppan Venkatesan, Lakshmanan Jothi

Journal of Minerals and Materials Characterization and Engineering Vol.9 No.5, August 26, 2021

DOI: 10.4236/jmmce.2021.95028 404 Downloads 1,731 Views Citations
Clinical Experience with the Fifth-Generation of a Breast Implant with a Smooth, Fine Surface from a Korean Manufacturer in Asian Women (Articles)

Dong Yeon Hwang, Sang Wha Kim, Joon Yong Jung, Robert Kim

Journal of Biosciences and Medicines Vol.10 No.6, June 22, 2022

DOI: 10.4236/jbm.2022.106012 318 Downloads 1,523 Views Citations
A Theoretical Study of Tris-(o-benzoquinonediimine)-First-Row Divalent Transition Metal Complexes (Articles)

Mohammad Abdul Matin, Samiran Bhattacharjee, Anwar Hossain

Advances in Chemical Engineering and Science Vol.13 No.2, April 21, 2023

DOI: 10.4236/aces.2023.132013 303 Downloads 1,173 Views Citations
Authentication and Secret Message Transmission Technique Using Discrete Fourier Transformation (Articles)

Debnath BHATTACHARYYA, Jhuma DUTTA, Poulami DAS, Samir Kumar BANDYOPADHYAY, Tai-hoon KIM

International Journal of Communications, Network and System Sciences Vol.2 No.5, August 21, 2009

DOI: 10.4236/ijcns.2009.25040 5,748 Downloads 10,477 Views Citations
Investigation of the Optical Properties of CdBr₂ (Articles)

Hamdollah Salehi, Nastaran Asareh

Optics and Photonics Journal Vol.1 No.1, March 11, 2011

DOI: 10.4236/opj.2011.11001 5,485 Downloads 13,217 Views Citations
Silica Nano-Networks as Stretches on Segmented SU8 Rods for Sub-Wavelength Photonics (Articles)

Francois Doré, Bruno Bêche, Nolwenn Huby, F. Artzner, Lionel Camberlein, Etienne Gaviot

Optics and Photonics Journal Vol.1 No.1, March 11, 2011

DOI: 10.4236/opj.2011.11003 4,473 Downloads 9,445 Views Citations
First-Principles Study of the Optical Properties of SrHfO₃ (Articles)

Hamdollah Salehi, Hosein Tolabinejad

Optics and Photonics Journal Vol.1 No.2, June 29, 2011

DOI: 10.4236/opj.2011.12012 6,208 Downloads 12,597 Views Citations
First Principles Studies on the Electronic Structure and Band Structure of Paraelectric SrTiO₃ by Different Approximations (Articles)

H. Salehi

Journal of Modern Physics Vol.2 No.9, September 16, 2011

DOI: 10.4236/jmp.2011.29111 9,034 Downloads 17,204 Views Citations
Efficient Theoretical Screening of Solid Sorbents for CO₂ Capture Applications (Articles)

Yuhua Duan, David Luebke, Henry Henry Pennline

International Journal of Clean Coal and Energy Vol.1 No.1, February 28, 2012

DOI: 10.4236/ijcce.2012.11001 8,609 Downloads 20,489 Views Citations
Quantification of Inositol Hexa-Kis Phosphate in Environmental Samples (Articles)

Lynne P. Heighton, Merle Zimmerman, Clifford P. Rice, Eton E. Codling, John A. Tossell, Walter F. Schmidt

Open Journal of Soil Science Vol.2 No.1, March 28, 2012

DOI: 10.4236/ojss.2012.21009 5,077 Downloads 8,673 Views Citations
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 6,916 Downloads 17,580 Views Citations
Ab Initio and Density Functional Theory (DFT) Study on Clonazepam (Articles)

Bachu Sylaja, Shanmugam Srinivasan

Open Journal of Biophysics Vol.2 No.3, July 27, 2012

DOI: 10.4236/ojbiphy.2012.23011 5,958 Downloads 12,397 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 5,090 Downloads 9,477 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
DFT Calculations on the Effect of Solvation on the Tautomeric Reactions for Wobble Gua-Thy and Canonical Gua-Cyt Base-Pairs (Articles)

Kazuya Nomura, Ryota Hoshino, Eisuke Shimizu, Yasuhiro Hoshiba, Victor I. Danilov, Noriyuki Kurita

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

DOI: 10.4236/jmp.2013.43A059 4,870 Downloads 8,097 Views Citations
This article belongs to the Special Issue on Density Functional Theory
Quantum Chemical Studies on the Corrosion Inhibition of Mild Steel by Piperidin-4-One Derivatives in 1 M H₃PO₄ (Articles)

Kalaiselvi Kathirvel, Brindha Thirumalairaj, Mallika Jaganathan

Open Journal of Metal Vol.4 No.4, October 30, 2014

DOI: 10.4236/ojmetal.2014.44009 4,474 Downloads 7,097 Views Citations
SARs Investigation of α-, β-, γ-, δ-, ε-RuCl₂(Azpy)₂ Complexes as Antitumor Drugs (Articles)

Kafoumba Bamba, Ouattara Wawohinlin Patrice, N’Guessan Kouakou Nobel, Nahossé Ziao

Computational Chemistry Vol.4 No.1, January 6, 2016

DOI: 10.4236/cc.2016.41001 3,305 Downloads 4,598 Views Citations

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