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Materials Science-Poland
Volume 31 (2013): Issue 3 (August 2013)
Open Access
Quantum chemical computational studies on bis-thiourea zinc acetate
Hacer Pir
Hacer Pir
,
Nergin Günay
Nergin Günay
,
Ömer Tamer
Ömer Tamer
,
Davut Avci
Davut Avci
,
Erdoğan Tarcan
Erdoğan Tarcan
and
Yusuf Atalay
Yusuf Atalay
| Aug 29, 2013
Materials Science-Poland
Volume 31 (2013): Issue 3 (August 2013)
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Published Online:
Aug 29, 2013
Page range:
357 - 371
DOI:
https://doi.org/10.2478/s13536-013-0112-x
Keywords
bis-thiourea zinc acetate (BTZA)
,
IR and NMR spectra
,
DFT and HF calculations
,
NLO and NBO analyses, conformational analysis
© 2013 Wroclaw University of Technology
This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.
Hacer Pir
Art and Science Faculty, Department of Physics, Sakarya University, 54187, Sakarya, Turkey
Nergin Günay
Art and Science Faculty, Department of Physics, Sakarya University, 54187, Sakarya, Turkey
Ömer Tamer
Art and Science Faculty, Department of Physics, Sakarya University, 54187, Sakarya, Turkey
Davut Avci
Art and Science Faculty, Department of Physics, Sakarya University, 54187, Sakarya, Turkey
Erdoğan Tarcan
Department of Physic, Kocaeli University, Kocaeli, Turkey
Yusuf Atalay
Art and Science Faculty, Department of Physics, Sakarya University, 54187, Sakarya, Turkey