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Journal Article
Pinto, R. M., A. A. Dias, M. Coreno, M. de Simone, B. M. Giuliano, J. P. Santos, and M. L. Costa. "Tautomerism in 5-methyltetrazole investigated by core-level photoelectron spectroscopy and ΔSCF calculations." Chemical Physics Letters 516 (2011): 149-153. AbstractWebsite

The relative populations of the 1H- and 2H-tautomer of gas-phase 5-methyltetrazole (5MTZ) have been assessed through core-level photoelectron spectroscopy, and compared with the results obtained from Gaussian-n (Gn, n = 1, 2 and 3) and Complete Basis Set methods (CBS-4M and CBS-Q). The C 1s and N 1s core‚Äìelectron binding energies (CEBEs) for each ionization site of both tautomers have been computed using the Œîself-consistent-field (ŒîSCF) approach. The C 1s and N 1s XPS spectra, obtained at 313 K, yield a 1H/2H tautomer ratio of ca. 0.16/0.84 and 0.21/0.79, respectively.

Guerra, M., J. M. Sampaio, T. I. Madeira, F. Parente, P. Indelicato, J. P. Marques, J. P. Santos, J. Hoszowska, Cl J. Dousse, L. Loperetti, F. Zeeshan, M. Muller, R. Unterumsberger, and B. Beckhoff. "Theoretical and experimental determination of L-shell decay rates, line widths, and fluorescence yields in Ge." Physical Review A 92 (2015): 022507-9. AbstractWebsite
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Guerra, M., R. M. Pinto, J. P. Santos, and A. C. S. Paiva. "Towards the assignment of the REMPI spectrum of Ph 2O using CIS and TD-DFT methods." Molecular Physics 111 (2013): 3311-3319. AbstractWebsite
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Guerra, M., R. M. Pinto, J. P. Santos, and A. C. S. Paiva. "Towards the assignment of the REMPI spectrum of Ph 2O using CIS and TD-DFT methods." Molecular Physics 111 (2013): 3311-3319. AbstractWebsite
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Guimarães, D., J. P. Santos, M. L. Carvalho, G. Vale, H. M. Santos, V. Geraldes, I. Rocha, and J. L. Capelo. "Ultrasonic energy as a tool to overcome some drawbacks in the determination of lead in brain tissue and urine of rats." Talanta 86 (2011): 442-446 . AbstractWebsite

An ultrasonic assisted solid‚Äìliquid extraction method was developed to determine the level of lead in the brain and urine of rats. Lead was determined by electrothermal atomic absorption spectrometry with longitudinal-Zeeman background correction. Several analytical drawbacks were addressed and overcome, namely small brain sample mass and the formation of precipitate in the urine samples. Utrasonication provided by an ultrasonic probe succeeded in extracting lead from brain samples. Furthermore, it was demonstrated that the formation of a precipitate lowered the lead content in the liquid phase of the urine. Lead was back extracted from the precipitate to the liquid phase with the aid of ultrasonic energy and acidifying the urine with 10% v/v nitric acid. A microwave-assisted acid digestion protocol was used to check the completeness of the lead extraction. The within bath and between bath precision was 5% (n = 9) and 7% (n = 3) respectively. The limit of quantification was 1.05 Œºg g‚àí1 for brain samples and 2.1 Œºg L‚àí1 for urine samples. A total of 6 samples of urine and 12 samples of brain from control rats and another 6 samples of urine and 12 samples of brain from rats fed with tap water rich in lead acetate were used in this research. Lead levels in brain and urine from exposed rats ranged from1.9 ¬± 0.2 Œºg g‚àí1 to 3.5 ¬± 0.2 Œºg g‚àí1 and from 752 ¬± 56 Œºg L‚àí1 to 60.9 ¬± 1.2 mg L‚àí1 respectively. Statistically significant differences of levels of lead in brain and urine were found between exposed and non exposed rats.

Guimarães, D., J. P. Santos, M. L. Carvalho, G. Vale, H. M. Santos, V. Geraldes, I. Rocha, and J. L. Capelo. "Ultrasonic energy as a tool to overcome some drawbacks in the determination of lead in brain tissue and urine of rats." Talanta 86 (2011): 442-446. AbstractWebsite

An ultrasonic assisted solid‚Äìliquid extraction method was developed to determine the level of lead in the brain and urine of rats. Lead was determined by electrothermal atomic absorption spectrometry with longitudinal-Zeeman background correction. Several analytical drawbacks were addressed and overcome, namely small brain sample mass and the formation of precipitate in the urine samples. Utrasonication provided by an ultrasonic probe succeeded in extracting lead from brain samples. Furthermore, it was demonstrated that the formation of a precipitate lowered the lead content in the liquid phase of the urine. Lead was back extracted from the precipitate to the liquid phase with the aid of ultrasonic energy and acidifying the urine with 10% v/v nitric acid. A microwave-assisted acid digestion protocol was used to check the completeness of the lead extraction. The within bath and between bath precision was 5% (n = 9) and 7% (n = 3) respectively. The limit of quantification was 1.05 Œºg g‚àí1 for brain samples and 2.1 Œºg L‚àí1 for urine samples. A total of 6 samples of urine and 12 samples of brain from control rats and another 6 samples of urine and 12 samples of brain from rats fed with tap water rich in lead acetate were used in this research. Lead levels in brain and urine from exposed rats ranged from1.9 ¬± 0.2 Œºg g‚àí1 to 3.5 ¬± 0.2 Œºg g‚àí1 and from 752 ¬± 56 Œºg L‚àí1 to 60.9 ¬± 1.2 mg L‚àí1 respectively. Statistically significant differences of levels of lead in brain and urine were found between exposed and non exposed rats.

Manso, M., S. Pessanha, M. Guerra, J. L. Figueirinhas, J. P. Santos, and M. L. Carvalho. "Unveiling the Third Secret of Fátima: μ-XRF quantitative characterization and 2D elemental mapping." Spectrochimica Acta Part B: Atomic Spectroscopy 130 (2017): 35-38. AbstractWebsite

Spectrochimica Acta Part B: Atomic Spectroscopy, 130 (2017) 35-38. doi:10.1016/j.sab.2017.02.006

Amaro, P., C. I. Szabo, S. Schlesser, A. Gumberidze, E. G. Kessler, A. Henins, E. O. Le Bigot, M. Trassinelli, J. M. Isac, P. Travers, M. Guerra, J. P. Santos, and P. Indelicato. "A vacuum double-crystal spectrometer for reference-free X-ray spectroscopy of highly charged ions." Radiation Physics and Chemistry 98 (2014): 132-149. AbstractWebsite

Radiation Physics and Chemistry, 98 + (2014) 132-149. doi:10.1016/j.radphyschem.2014.01.015

Amaro, P., C. I. Szabo, S. Schlesser, A. Gumberidze, E. G. Kessler, A. Henins, E. O. Le Bigot, M. Trassinelli, J. M. Isac, P. Travers, M. Guerra, J. P. Santos, and P. Indelicato. "A vacuum double-crystal spectrometer for reference-free X-ray spectroscopy of highly charged ions." Radiation Physics and Chemistry 98 (2014): 132-149. AbstractWebsite

Radiation Physics and Chemistry, 98 + (2014) 132-149. doi:10.1016/j.radphyschem.2014.01.015

Ménesguen, Y., M. - C. Lépy, J. M. Sampaio, J. P. Marques, F. Parente, M. Guerra, P. Indelicato, J. P. Santos, P. Hönicke, and B. Beckhoff. "{A combined experimental and theoretical approach to determine X-ray atomic fundamental quantities of tin}." X-Ray Spectrom. 47 (2018): 341-351. Abstract
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Ménesguen, Y., M. - C. Lépy, J. M. Sampaio, J. P. Marques, F. Parente, M. Guerra, P. Indelicato, and J. P. Santos. "{Experimental and theoretical determination of the L-fluorescence yields of bismuth}." Metrologia 55 (2018): 621-630. Abstract
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Machado, J., C. I. Szabo, J. P. Santos, P. Amaro, M. Guerra, A. Gumberidze, Guojie Bian, J. M. Isac, and P. Indelicato. "{High-precision measurements of $n=2\rightarrow n=1$ transition energies and level widths in He- and Be-like argon ions}." Phys. Rev. 97 (2018): 032517. Abstract
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Monteiro, C. M. B., F. D. Amaro, M. S. Sousa, M. Abdou-Ahmed, P. Amaro, F. Biraben, T. Chen, D. S. Covita, A. J. Dax, M. Diepold, L. M. P. Fernandes, B. Franke, S. Galtier, A. L. Gouvêa, J. Götzfried, T. Graf, T. W. Hansch, M. Hildebrandt, P. Indelicato, L. Julien, K. Kirch, A. Knecht, F. Kottmann, J. J. Krauth, Y. Liu, J. Machado, F. Mulhauser, B. Naar, T. Nebel, F. Nez, R. Pohl, J. P. Santos, J. M. F. dos Santos, K. Schuhmann, C. I. Szabo, D. Taqqu, J. F. C. A. Veloso, and A. Antognini. "{On the double peak structure of avalanche photodiode response to monoenergetic x-rays at various temperatures and bias voltages}." J. Inst. 13 (2018): C01033. Abstract
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LIDON, FERNANDO CEBOLA, KARLIANA OLIVEIRA, CARLOS GALHANO, Mauro Guerra, MARIA MANUELA RIBEIRO, JOÃO PELICA, INÊS PATACO, JOSÉ COCHICHO RAMALHO, ANTÓNIO EDUARDO LEITÃO, ANA SOFIA ALMEIDA, PAULA SCOTTI CAMPOS, Ana Ribeiro-Barros, ISABEL P. PAIS, Maria Manuela Silva, Maria Luisa Carvalho, Jose Paulo Santos, MARIA FERNANDA PESSOA, and FERNANDO HENRIQUE REBOREDO. "{SELENIUM BIOFORTIFICATION OF RICE THROUGH FOLIAR APPLICATION WITH SELENITE AND SELENATE}." Experimental Agriculture (2018): 1-15. Abstract

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de J Mangueze, Adilson V., Maria F. G. Pessoa, Maria J. Silva, Alexis Ndayiragije, Hilário E. Magaia, Viriato S. I. Cossa, Fernando H. Reboredo, Maria L. Carvalho, José P. Santos, Mauro Guerra, ANA I. RIBEIRO-BARROS, Fernando C. Lidon, and José C. Ramalho. "{Simultaneous Zinc and selenium biofortification in rice. Accumulation, localization and implications on the overall mineral content of the flour}." Journal of Cereal Science 82 (2018): 34-41. Abstract
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Guerra, M., J. M. Sampaio, F. Parente, P. Indelicato, P. Hönicke, M. Muller, B. Beckhoff, J. P. Marques, and J. P. Santos. "{Theoretical and experimental determination of $K$- and $L$-shell x-ray relaxation parameters in Ni}." Phys. Rev. A 97 (2018): 042501. Abstract
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