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Research article

First published 2002-11

Ab initio Study of Configurations of Cycloundeca-1,2,4,5,7,8,10-heptaene

Davood Nori-Shargh, Bita Soltani, Saeed Jameh-Bozorghi [...]

Journal of Chemical Research

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Research article

First published 2003-9

Ab Initio Study of Conformational Properties of ( Z,Z,Z )-Cyclonona-1,3,6-Triene

Davood Nori-Shargh, Mostafa Mohammadpour Amini, Saeed Jameh-Bozorghi [...]

Journal of Chemical Research

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Research article

First published 2025-9

Mechanical behavior of porous silicon: Ab initio and nanoindentation study

S. Bouchendouka, H. Lachenani, Y. Belaroussi [...]

Materials Science and Technology

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Research article

First published 2007-11

Molecular modeling of bioactive selenium compounds

Craig A. Bayse, Sonia Antony

Main Group Chemistry

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Research article

First published 2003-7

Ab initio Study of Configurational and Conformational Properties of Cyclodeca-1,2,4,6,7,9-Hexaene and Cyclodeca-1,2,4,6,8,9-Hexaene †

Davood Nori-Shargh, Nasrin Sarogh-Farahani, Saeed Jameh-Bozorghi [...]

Journal of Chemical Research

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Research article

First published 2010-5

Ab initio and DFT study of the static dipole (hyper)polarizabilities of benzaldehyde and thio-benzaldehyde molecules in gas phase

Humberto Soscún

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 1998-11

Initiation Reactions of Lipid Peroxidation: A Raman Spectroscopic and Quantum-Mechanical Study

Hiroyasu Tachikawa, Martin Polášek, Joan Q. Huang [...]

Applied Spectroscopy

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Research article

First published 2012-3

A Quinoline Based bis-Urea Receptor for Anions: A Selective Receptor for Hydrogen Sulfate

Tiffany H. Russ, Avijit Pramanik, Maryam E. Khansari [...]

Natural Product Communications

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Research article

First published 2012-7

DFT and ab-initio study on the mechanism of the gas-phase elimination kinetics of 1-chloro-3-methylbut-2-ene and 3-chloro-3-methylbut-1-ene and their isomerization

Jesús Lezama, José R. Mora, Edgar Márquez [...]

Journal of Computational Methods in Sciences and Engineering

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Research article

First published 2018-5

Analysis,design and synthesis of water-based magnetorheological fluid for CMMRF process

Prabhat Ranjan, R. Balasubramaniam, V. K. Jain

Journal of Micromanufacturing

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