Thursday, March 11, 2010

PUBLICATIONS

---N. Y. Dzade, A. Roldan, and N. H. de Leeuw, Structures and properties of As(OH)3 adsorption complexes on hydrated mackinawite (FeS) surfaces: A DFT-D2 study. Environ. Sci. Technol (2017) DOI: 10.1021/acs.est.7b00107













---C. Kwawu, R. Tia, E. Adei, N.Y. Dzade, C.R.A. Catlow, N.H. de Leeuw, Effect of nickel monolayer deposition on the structural and electronic properties of the low miller indices of (bcc) iron - A DFT study. Applied Surface Science 400 (2017) 293–303









---L. Wu, N. Y. Dzade, L. Gao, D. O. Scanlon, Z. Öztürk, N. Hollingsworth, B. M. Weckhuysen, E. J. M. Hensen, N. H. de Leeuw, and J. P. Hofmann. Outside Back Cover, Photoelectrochemistry: Enhanced Photoresponse of FeS2 Films: The Role of Marcasite–Pyrite Phase Junctions. Advanced Materials, 2016; DOI: 10.1002/adma.201670305;



















---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. Surface and shape modification of mackinawite (FeS) nanocrystals by cysteine adsorption: a first-principles DFT-D2 study. Phys. Chem. Chem. Phys. 2016. DOI: 10.1039/c6cp05913a.



















---L. Wu, N. Y. Dzade, L. Gao, D. O. Scanlon, Z. Öztürk, N. Hollingsworth, B. M. Weckhuysen, E. J. M. Hensen, N. H. de Leeuw, and J. P. Hofmann. Enhanced Photoresponse of FeS2 Films: The Role of Marcasite–Pyrite Phase Junctions. Advanced Materials, 2016; doi:10.1002/adma.201602222;



















---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. DFT-D2 Study of the Adsorption and Dissociation of Water on Clean and Oxygen-Covered {001} and {011} Surfaces of Mackinawite (FeS). J. Phys. Chem. C, 2016; DOI: 10.1021/acs.jpcc.6b06122













---J. B. Awuah, N. Y. Dzade, R. Tia, E. Adei, B. Kwakye-Awuah, C. R. A. Catlow and N. H. de Leeuw A density functional theory study of arsenic immobilization by the Al(III)-modified zeolite clinoptilolite. Phys. Chem. Chem. Phys., 2016,18, 11297-11305; DOI: 10.1039/C6CP00190D















---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. DFT-D2 simulations of water adsorption and dissociation on the low-index surfaces of mackinawite (FeS). J. Chem. Phys. 144, 174704 (2016); http://dx.doi.org/10.1063/1.4947588.



















---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. Activation and dissociation of CO2 on the (001), (011), and (111) surfaces of mackinawite (FeS): A dispersion-corrected DFT study. J. Chem. Phys. 143, 094703 (2015), http://dx.doi.org/10.1063/1.4929470















---N. Y. Dzade, A. Roldan, and N.H. de Leeuw. The surface chemistry of NOx on mackinawite (FeS) surfaces: A DFT-D2 study. Phys. Chem. Chem. Phys., 16, 15444-15456 (2014), DOI: 10.1039/C4CP01138D















---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. A Density Functional Theory Study of the Adsorption of Benzene on Hematite (alpha-Fe2O3) Surfaces Journal of Minerals, 4, 89-115 (2014), doi:10.3390/min4010089











---S. S. Tafreshi, A. Roldan, N. Y. Dzade, N. H. de Leeuw. Adsorption of hydrazine on the perfect and defective copper (111) surface: A dispersion-corrected DFT study. Surface Science 622, 1-8 (2013), http://dx.doi.org/10.1016/j.susc.2013.11.013







---N. Y. Dzade, A. Roldan, and N. H. de Leeuw. Adsorption of Methylamine on Mackinawite (FeS): A Density Functional Theory Study J. Chem. Phys. 139, 124708 (2013), http://dx.doi.org/10.1063/1.4822040



















---N. Y. Dzade, K. O. Obodo, S. K. Adjokatse, A. C. Ashu, E. Amankwah,C. D. Atiso, A. A. Bello, E. Igumbor, S. B. Nzabarinda, J. T. Obodo, A. O. Ogbuu, O. Femi, J. O. Udeigwe and U. V. Waghmare.Silicene and Transition Metal Based Materials: prediction of a two-dimensional piezomagnet.J. Phys. Condens. Matter 22 (2010) 375502
















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Difficulties Are Opportunites

Difficulties are opportunities to better things, they are stepping stones to greater experiences. Perhaps some day you will be thankful for some temporary failures in a particular direction. When one door closes, another always opens, as a natural law it has to be, to balance.


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Progress is made by those who do what they are afraid to do. Progress is made by those who do what they did not previously know they could do.

You cannot push the world forward by staying safe and comfortable. You cannot make great advances by holding tightly to the tired excuses and outdated assumptions.

It is energizing and liberating to turn down a road you have not traveled before. To reach toward what you cannot yet touch brings new passion and strength to your life.

You are amazingly able to do not only what you have already done, but also what you cannot yet do. Your capacity for learning and improvement has no limit.

Beyond where you are comfortable is where you will grow and improve and achieve. Nudge yourself away from what you already know, and discover how very much more you can be.

Give yourself the priceless gifts of new experiences, new skills, new knowledge and the confidence of knowing how quickly you can grow. Expand your horizons, again and again, and discover that every limit is there to be transcended.

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