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Journal of Theoretical Chemistry

ISSN: 2314--6184
Publisher: Hindawi Publishing Corporation


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Structures and Stabilities of Alkaline Earth Metal Oxide Nanoclusters: A DFT Study

Author(s): Prinka Batra | Ritu Gaba | Upasana Issar | Rita Kakkar
Volume: 2013
Year: 2013
Electron Momentum Density and Phase Transition in ZnS

Author(s): N. Munjal | M. C. Mishra | G. Sharma | B. K. Sharma
Volume: 2013
Year: 2013
Metal Ion Selectivity of Kojate Complexes: A Theoretical Study

Author(s): Sarita Singh | Jyoti Singh | Sunita Gulia | Rita Kakkar
Volume: 2013
Year: 2013
DFT Description of Intermolecular Forces between 9-Aminoacridines and DNA Base Pairs

Author(s): Sandra Cotes Oyaga | José Cotuá Valdés | Sigrid Borja Paez | Keylin Hurtado Marquez
Volume: 2013
Year: 2013
A Computational Determination of the Lowest Energy Electronic and Geometric States of First Row Transition Metal Dioxygen Dications

Author(s): Jillian Lennartz | Eric Dumas | Lennie Ramirez | John Morrison Galbraith
Volume: 2013
Year: 2013
Vibrational Spectroscopic Investigation and Conformational Analysis of Methacrylamidoantipyrine: A Comparative Density Functional Study

Author(s): Özgür Alver | Mehmet Fatih Kaya | Metin Bilge | Cemal Parlak
Volume: 2013
Year: 2013
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