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Biomonitoring human exposure to environmental carcinogenic chemicals.

• P. B. Farmer, Ovnair Sepai, +22 authors P. Castelain
• Mutagenesis
• 1996

A coordinated study was carried out on the development, evaluation and application of biomonitoring procedures for populations exposed to environmental genotoxic pollutants. The procedures used… (More)

Theoretical investigation of the interaction of CH(4) with Al(2) and Al(3) neutral and charged clusters.

• Estella Alexandrou, A. Groß, Naoum C. Bacalis
• The Journal of chemical physics
• 2010

We have studied the interaction of CH(4) with Al(2) and Al(3) neutral and charged clusters in the two lowest lying spin states using density functional theory. These calculations, via extended… (More)

Impact of human activities on the quality of river water: The case of Evrotas River catchment basin, Greece.

• Matthew Angelidis, P G Markantonatos, Naoum C. Bacalis
• Environmental monitoring and assessment
• 1995

The impact of point (domestic and industrial effluents) and non-point (agricultural land runoff) pollution sources on the quality of the receiving waters of the Evrotas River (Laconia, Greece) was… (More)

Theoretical study of the O₂ interaction with a tetrahedral Al₄ cluster.

• Naoum C. Bacalis, Aristophanes Metropoulos, A. Groß
• The journal of physical chemistry. A
• 2010

Employing both multireference configuration interaction (MRCI) and density functional theory (DFT) methods, we have studied the interaction of O₂ with a tetrahedral Al₄ cluster in the total spin… (More)

Minimization principle for non degenerate excited states (independent of orthogonality to lower lying known approximants)

• Naoum C. Bacalis
• J. Comput. Meth. in Science and Engineering
• 2016

Correct small-truncated excited state wave functions obtained via minimization principle for excited states compared/ opposed to Hylleraas-Undheim and McDonald higher "roots"

• Z. Xiong, J. Zang, H. J. Liu, D. Karaoulanis, Q. Zhou, Naoum C. Bacalis
• J. Comput. Meth. in Science and Engineering
• 2017

Electronic Structure: Metals, Half Metals, Insulators James Tobin, Chairman Applications of the NRL tight-binding method to magnetic systems

• Marco Mehl, Dimitrios A. Papaconstantopoulos, I. I. Mazin, Naoum C. Bacalis, W. E. Pickett
• 2001

The NRL developed tight-binding method has been very successful in describing the properties of nonmagnetic elemental metals and semiconductors with accuracy comparable to first-principles methods.… (More)

Applications of the NRL tight-binding method to magnetic systems

• Marco Mehl, Dimitrios A. Papaconstantopoulos, I. I. Mazin, Naoum C. Bacalis, W. E. Pickett
• 2001

The NRL developed tight-binding method has been very successful in describing the properties of nonmagnetic elemental metals and semiconductors with accuracy comparable to first-principles methods.… (More)

Inherent restrictions of the Hylleraas-Undheim-MacDonald higher roots, and minimization functionals at the excited states

• Naoum C. Bacalis, Z. Xiong, D. Karaoulanis
• J. Comput. Meth. in Science and Engineering
• 2008

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