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1,128 articles with title/keywords/abstract containing QUANTUM CHEMISTRY

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Development of additive isotropic site potential for exchange-repulsion energy, based on intermolecular perturbation theory

Authors: Yokogawa, Daisuke; Sato, Hirofumi; Gusarov, Sergey; Kovalenko, Andriy

Source: Canadian Journal of Chemistry, Volume 87, Number 12, 1 December 2009 , pp. 1727-1732(6)

Publisher: NRC Research Press

Charge transfer in metal-atom-containing molecules in the gas phase

Authors: Shafizadeh, Niloufar; Soep, Benoit; Mestdagh, Jean Michel; Breckenridge, W. H.

Source: International Reviews in Physical Chemistry, Volume 28, Number 3, July 2009 , pp. 359-406(48)

Publisher: Taylor and Francis Ltd

Reducing the Photocatalytic Activity of Zinc Oxide Quantum Dots by Surface Modification

Authors: Wang, Jinfeng; Tsuzuki, Takuya; Sun, Lu; Wang, Xungai

Source: Journal of the American Ceramic Society, Volume 92, Number 9, September 2009 , pp. 2083-2088(6)

Publisher: Blackwell Publishing

Health effects of inhaled engineered and incidental nanoparticles

Authors: Madl, Amy K.; Pinkerton, Kent E.

Source: Critical Reviews in Toxicology, Volume 39, Number 8, September 2009 , pp. 629-658(30)

Publisher: Informa Healthcare

Systematic trends in electronic properties of alkali hydrides

Authors: Aymar, Mireille; Deiglmayr, Johannes; Dulieu, Olivier

Source: Canadian Journal of Physics, Volume 87, Number 5, 1 May 2009 , pp. 543-556(14)

Publisher: NRC Research Press

Hydrogen evolution and oxidation—a prototype for an electrocatalytic reaction

Authors: Santos, E.; Lundin, A.; Pötting, K.; Quaino, P.; Schmickler, W.

Source: Journal of Solid State Electrochemistry, Volume 13, Number 7, July 2009 , pp. 1101-1109(9)

Publisher: Springer

Luminescence and Energy Transfer in Water Soluble CeF3 and CeF3:Tb3+ Nanoparticles

Authors: Sun, Zhong; Li, Yuebin; Zhang, Xing; Yao, Mingzhen; Ma, Lun; Chen, Wei

Source: Journal of Nanoscience and Nanotechnology, Volume 9, Number 11, November 2009 , pp. 6283-6291(9)

Publisher: American Scientific Publishers

A Theoretical Study of Resveratrol Oxidation

Authors: Gomes, Bruno A.Q.; Queiroz, Auriekson N.; Borges, Rosivaldo S.

Source: Journal of Computational and Theoretical Nanoscience, Volume 6, Number 7, July 2009 , pp. 1637-1639(3)

Publisher: American Scientific Publishers

A DFT Study of Aminophenol Stability

Authors: Silva, Emilin R.; Queiroz, Auriekson N.; Almeida, Eduardo D.; Borges, Rosivaldo S.

Source: Journal of Computational and Theoretical Nanoscience, Volume 6, Number 7, July 2009 , pp. 1694-1696(3)

Publisher: American Scientific Publishers

The Infrared Spectra of Bacillus Bacteria Part II: Sporulated Bacillus—The Effect of Vegetative Cells and Contributions of Calcium Dipicolinate Trihydrate, CaDP·3H2O

Authors: Johnson, Timothy J.; Williams, Stephen D.; Valentine, Nancy B.; Su, Yin-Fong

Source: Applied Spectroscopy, Volume 63, Issue 8, Pages 184A-214A and 859-978, (August 2009) , pp. 908-915(8)

Publisher: Society for Applied Spectroscopy

Solvothermal Synthesis of InP Quantum Dots

Authors: Nag, Angshuman; Sarma, D.D.

Source: Journal of Nanoscience and Nanotechnology, Volume 9, Number 9, September 2009 , pp. 5633-5636(4)

Publisher: American Scientific Publishers

Intensity Tracking for Vibrational Spectra of Large Molecules

Authors: Kiewisch, Karin; Luber, Sandra; Neugebauer, Johannes; Reiher, Markus

Source: CHIMIA International Journal for Chemistry, Volume 63, Number 5, May 2009 , pp. 270-274(5)

Publisher: Swiss Chemical Society

Optimum performance solar cells using atmospheric pressure chemical vapour deposition deposited TCOs

Authors: Yates, H.M.; Evans, P.; Sheel, D.W.; Remes, Z.; Vanecek, M.; Dagkaldiran, U.; Gordijn, A.; Finger, F.

Source: International Journal of Nanotechnology, Volume 6, Number 9, 24 June 2009 , pp. 816-827(12)

Publisher: Inderscience Publishers

Flash Vacuum Thermolysis of 4H-3,1-Benzodithiin-4-thione: UV-Photoelectron Spectroscopy Characterization of Benzothiet-2-thione and Quantum Chemistry Studies

Authors: Drewnowski, Tomasz; Leśniak, Stanisław; Chrostowska, Anna; Dargelos, Alain; Khayar, Said

Source: Phosphorus, Sulfur, and Silicon and the Related Elements, Volume 184, Number 5, May 2009 , pp. 1269-1284(16)

Publisher: Taylor and Francis Ltd

The Chemistry of Alk-1-yn-1-yl Disulfides—A Review

Author: Senning, Alexander

Source: Phosphorus, Sulfur, and Silicon and the Related Elements, Volume 184, Number 5, May 2009 , pp. 1340-1346(7)

Publisher: Taylor and Francis Ltd

Electronically excited states of XOONO (X=Cl, Br): theoretical studies

Authors: Lesar, A.; Hodoscek, M.

Source: Molecular Physics, Volume 107, Number 7, October 2009 , pp. 693-700(8)

Publisher: Taylor and Francis Ltd

Recent Advances in Nanoparticle Preparation by Spray and Microemulsion Methods

Authors: Eslamian, Morteza; Shekarriz, Marzieh

Source: Recent Patents on Nanotechnology, Volume 3, Number 2, June 2009 , pp. 99-115(17)

Publisher: Bentham Science Publishers

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