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1

Direct Conversion of Methane to Methanol on Ni-Ceria Surfaces: Metal-Support Interactions and Water-enabled Catalytic Conversion by Site Blocking

Lustemberg, Pablo G., Palomino, Robert M., Gutierrez, Ramon A, Grinter, David C., Vorokhta, Mykhailo, Liu, Zongyuan, Ramirez, Pedro J, Matolín, Vladimír, Ganduglia-Pirovano, M. Veronica, Senanayake, S

Journal:

Journal of the American Chemical Society

Year:

2018

Language:

english

File:

PDF, 905 KB

english, 2018

2

Epidemiological study of influenza virus infections in young adult outpatients from Buenos Aires, Argentina

Cecilia Santamaría, Analía Urueña, Cristina Videla, Ariel Suarez, Cecilia Ganduglia, Guadalupe Carballal, Pablo Bonvehi, Marcela Echavarría

Journal:

Influenza and Other Respiratory Viruses

Year:

2008

Language:

english

File:

PDF, 65 KB

english, 2008

3

Interference, resonances, and bound states at the Pd(001) and Rh(001) surfaces

Ganduglia-Pirovano, M. V., Cohen, M. H., Kudrnovský, J.

Journal:

Physical Review B

Year:

1994

Language:

english

File:

PDF, 283 KB

english, 1994

4

Electron correlations in the ground state of silicon

Ganduglia-Pirovano, M. V., Stollhoff, G., Fulde, P., Bohnen, K. P.

Journal:

Physical Review B

Year:

1989

Language:

english

File:

PDF, 506 KB

english, 1989

5

Electronic structure of random Ag-Pd and Ag-vacancy overlayers on an fcc Pd(001) substrate

Ganduglia-Pirovano, M. V., Kudrnovský, J., Turek, I., Drchal, V., Cohen, M. H.

Journal:

Physical Review B

Year:

1993

Language:

english

File:

PDF, 311 KB

english, 1993

6

Adlayer core-level shifts of admetal monolayers on transition-metal substrates and their relation to the surface chemical reactivity

Hennig, D., Ganduglia-Pirovano, M. V., Scheffler, M.

Journal:

Physical Review B

Year:

1996

Language:

english

File:

PDF, 55 KB

english, 1996

7

Hydrogen activation, diffusion, and clustering on CeO2(111): A DFT+U study

Fernández-Torre, Delia, Carrasco, Javier, Ganduglia-Pirovano, M. Verónica, Pérez, Rubén

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.81 MB

english, 2014

8

Room Temperature Activation of Methane and Dry Reforming with CO 2 on Ni-CeO 2 (111) Surfaces: Effect of Ce 3+ Sites and Metal-Support Interactions on C-H bond Cleavage

Lustemberg, Pablo Germán, Ramirez, Pedro J, Liu, Zongyuan, Gutierrez, Ramon A, Grinter, David G., Carrasco, Javier, Senanayake, Sanjaya, Rodriguez, Jose A., Ganduglia-Pirovano, M. Veronica

Journal:

Year:

2016

Language:

english

File:

PDF, 4.13 MB

english, 2016

9

Surface Stabilizes Ceria in Unexpected Stoichiometry

Olbrich, Reinhard, Murgida, Gustavo E., Ferrari, Valeria, Barth, Clemens, Llois, Ana M., Reichling, Michael, Ganduglia-Pirovano, M. Verónica

Journal:

The Journal of Physical Chemistry C

Year:

2017

Language:

english

File:

PDF, 13.58 MB

english, 2017

10

Relative Stability of Near-Surface Oxygen Vacancies at the CeO 2 (111) Surface upon Zirconium Doping

Otero, G. S., Lustemberg, P. G., Prado, F., Ganduglia-Pirovano, M. V.

Journal:

The Journal of Physical Chemistry C

Year:

2019

Language:

english

File:

PDF, 4.15 MB

english, 2019

11

Relative Stability of Near-Surface Oxygen Vacancies at the CeO 2 (111) Surface upon Zirconium Doping

Otero, G. S., Lustemberg, P. G., Prado, F., Ganduglia-Pirovano, M. V.

Journal:

The Journal of Physical Chemistry C

Year:

2019

File:

PDF, 4.15 MB

2019

12

Insight into the mechanism of the water-gas shift reaction over Au/CeO 2 catalysts using combined operando spectroscopies

Ziemba, Marc, Ganduglia-Pirovano, Veronica, Hess, Christian

Journal:

Faraday Discussions

Year:

2020

Language:

english

File:

PDF, 1.35 MB

english, 2020

13

Formaldehydbildung auf den Vanadiumoxidoberflächen V2O3(0001) und V2O5(001): Wie bildet sich der stabile Methoxy-Zwischenzustand?

Daniel Göbke, Yuriy Romanyshyn, Sébastien Guimond, Jacobus Marinus Sturm, Helmut Kuhlenbeck, Jens Döbler, Ulrike Reinhardt, Maria Veronica Ganduglia-Pirovano, Joachim Sauer, Hans-Joachim Freund

Journal:

Angewandte Chemie

Year:

2009

Language:

german

File:

PDF, 514 KB

german, 2009

14

Resolving the Atomic Structure of Vanadia Monolayer Catalysts: Monomers, Trimers, and Oligomers on Ceria

Martin Baron, Heather Abbott, Oleksandr Bondarchuk, Dario Stacchiola, Alexander Uhl, Shamil Shaikhutdinov, Hans-Joachim Freund, Cristina Popa, Maria Veronica Ganduglia-Pirovano, Joachim Sauer

Journal:

Angewandte Chemie

Year:

2009

Language:

english

File:

PDF, 556 KB

english, 2009

15

Formaldehyde Formation on Vanadium Oxide Surfaces V2O3(0001) and V2O5(001): How does the Stable Methoxy Intermediate Form?

Daniel Göbke, Yuriy Romanyshyn, Sébastien Guimond, Jacobus Marinus Sturm, Helmut Kuhlenbeck, Jens Döbler, Ulrike Reinhardt, Maria Veronica Ganduglia-Pirovano, Joachim Sauer, Hans-Joachim Freund

Journal:

Angewandte Chemie International Edition

Year:

2009

Language:

english

File:

PDF, 513 KB

english, 2009

16

Resolving the Atomic Structure of Vanadia Monolayer Catalysts: Monomers, Trimers, and Oligomers on Ceria

Martin Baron, Heather Abbott, Oleksandr Bondarchuk, Dario Stacchiola, Alexander Uhl, Shamil Shaikhutdinov, Hans-Joachim Freund, Cristina Popa, Maria Veronica Ganduglia-Pirovano, Joachim Sauer

Journal:

Angewandte Chemie International Edition

Year:

2009

Language:

english

File:

PDF, 556 KB

english, 2009

17

Oxygen vacancies in transition metal and rare earth oxides: Current state of understanding and remaining challenges

M. Verónica Ganduglia-Pirovano, Alexander Hofmann, Joachim Sauer

Journal:

Surface Science Reports

Year:

2007

Language:

english

File:

PDF, 4.65 MB

english, 2007

18

Atomistic description of oxide formation on metal surfaces: the example of ruthenium

Karsten Reuter, Catherine Stampfl, M. Verónica Ganduglia-Pirovano, Matthias Scheffler

Journal:

Chemical Physics Letters

Year:

2002

Language:

english

File:

PDF, 2.75 MB

english, 2002

19

Effect of the surface model on the theoretical description of the chemisorption of atomic hydrogen on Cu(0 0 1)

D Domı́nguez-Ariza, C Sousa, N.M Harrison, M.V Ganduglia-Pirovano, F Illas

Journal:

Surface Science

Year:

2003

Language:

english

File:

PDF, 373 KB

english, 2003

20

Distribution ofAnisakis simplexin fish caught in the Ligurian Sea

M. T. Manfredi, G. Crosa, P. Galli, S. Ganduglia

Journal:

Parasitology Research

Year:

2000

Language:

english

File:

PDF, 60 KB

english, 2000

21

Selectivity in Methanol Oxidation as Studied on Model Systems Involving Vanadium Oxides

Y. Romanyshyn, S. Guimond, H. Kuhlenbeck, S. Kaya, R. P. Blum, H. Niehus, S. Shaikhutdinov, V. Simic-Milosevic, N. Nilius, H.-J. Freund, M. V. Ganduglia-Pirovano, R. Fortrie, J. Döbler, J. Sauer

Journal:

Topics in Catalysis

Year:

2008

Language:

english

File:

PDF, 883 KB

english, 2008

22

Methanol Adsorption on V2O3(0001)

Y. Romanyshyn, S. Guimond, D. Göbke, J. M. Sturm, H. Kuhlenbeck, J. Döbler, M. V. Ganduglia-Pirovano, J. Sauer, H.-J. Freund

Journal:

Topics in Catalysis

Year:

2011

Language:

english

File:

PDF, 2.59 MB

english, 2011

23

Low temperature adsorption of oxygen on reduced V2O3(0 0 0 1) surfaces

M. Abu Haija, S. Guimond, Y. Romanyshyn, A. Uhl, H. Kuhlenbeck, T.K. Todorova, M.V. Ganduglia-Pirovano, J. Döbler, J. Sauer, H.-J. Freund

Journal:

Surface Science

Year:

2006

Language:

english

File:

PDF, 352 KB

english, 2006

24

Formation of the cerium orthovanadate CeVO4: DFT+U study

Da Silva, Juarez, Ganduglia-Pirovano, M., Sauer, Joachim

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 309 KB

english, 2007

25

ChemInform Abstract: Chemical Reactivity Theory for Physicists; a Work in Progress

M. H. COHEN, M. V. GANDUGLIA-PIROVANO, V. NATOLI, J. KUDRNOVSKY

Journal:

Year:

1996

File:

PDF, 25 KB

1996

26

Overlayer and interface resonances and bound states at PdAg(001) and AgPd(001) surfaces

M.V. Ganduglia-Pirovano, M.H. Cohen, J. Kudrnovský

Journal:

Surface Science

Year:

1995

Language:

english

File:

PDF, 412 KB

english, 1995

27

The electronic structure of a model bimetallic catalyst: symmetry-resolved density of states at ̄gG for CuRu(111)

V. Natoli, M.H. Cohen, M.V. Ganduglia-Pirovano, J. Kudrnovský, I. Turek, V. Drchal

Journal:

Surface Science

Year:

1995

Language:

english

File:

PDF, 422 KB

english, 1995

28

The structure of epitaxial V2O3 films and their surfaces: A medium energy ion scattering study

A.J. Window, A. Hentz, D.C. Sheppard, G.S. Parkinson, D.P. Woodruff, W. Unterberger, T.C.Q. Noakes, P. Bailey, M.V. Ganduglia-Pirovano, J. Sauer

Journal:

Surface Science

Year:

2012

Language:

english

File:

PDF, 2.88 MB

english, 2012

29

Pancreatitis caused by duodenal duplication

Girolamo Mattioli, Piero Buffa, Ferdinando Pesce, Arrigo Barabino, Paolo Ganduglia, Giuseppe Fratino, Claudio Granata, Michele Torre, GianMichele Magnano, Claudio Gambini, Giorgio Ivani, Vincenzo Jaso

Journal:

Journal of Pediatric Surgery

Year:

1999

Language:

english

File:

PDF, 3.05 MB

english, 1999

30

Catalysis and corrosion: the theoretical surface-science context

Catherine Stampfl, M. Veronica Ganduglia-Pirovano, Karsten Reuter, Matthias Scheffler

Journal:

Surface Science

Year:

2002

Language:

english

File:

PDF, 625 KB

english, 2002

31

Nitrogen adsorption on Fe(111), (100), and (110) surfaces

J.J. Mortensen, M.V. Ganduglia-Pirovano, L.B. Hansen, B. Hammer, P. Stoltze, J.K. Nørskov

Journal:

Surface Science

Year:

1999

Language:

english

File:

PDF, 276 KB

english, 1999

32

Orbital symmetry, reactivity, and transition metal surface chemistry

Cohen, M. H., Ganduglia-Pirovano, M. V., Kudrnovský, J.

Journal:

Physical Review Letters

Year:

1994

Language:

english

File:

PDF, 276 KB

english, 1994

33

Hybrid functionals applied to rare-earth oxides: The example of ceria

Da Silva, Juarez L. F., Ganduglia-Pirovano, M. Verónica, Sauer, Joachim, Bayer, Veronika, Kresse, Georg

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 650 KB

english, 2007

34

PHP54 Predictors of Avoidable Emergency Room Visits Among High Cost Medicaid Enrollees

C. Ganduglia, L. Franzini, K. Dunn

Journal:

Value in Health

Year:

2011

Language:

english

File:

PDF, 67 KB

english, 2011

35

Theoretical Studies of the Adsorption of CO and C on Ni(111) and Ni/CeO 2 (111): Evidence of a Strong Metal–Support Interaction

Carrasco, Javier, Barrio, Laura, Liu, Ping, Rodriguez, José A., Ganduglia-Pirovano, M. Verónica

Journal:

The Journal of Physical Chemistry C

Year:

2013

Language:

english

File:

PDF, 2.88 MB

english, 2013

36

Reactivity kernels, the normal modes of chemical reactivity, and the hardness and softness spectra

Cohen, Morrel H., Ganduglia-Pirovano, M. V., Kudrnovský, J.

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 559 KB

english, 1995

37

Surface Using Density-Functional and Statistical Calculations

Murgida, Gustavo E., Ganduglia-Pirovano, M. Verónica

Journal:

Physical Review Letters

Year:

2013

Language:

english

File:

PDF, 841 KB

english, 2013

38

Electron Localization in Defective Ceria Films: A Study with Scanning-Tunneling Microscopy and Density-Functional Theory

Jerratsch, Jan-Frederik, Shao, Xiang, Nilius, Niklas, Freund, Hans-Joachim, Popa, Cristina, Ganduglia-Pirovano, M. Veronica, Burow, Asbjörn M., Sauer, Joachim

Journal:

Physical Review Letters

Year:

2011

Language:

english

File:

PDF, 1.44 MB

english, 2011

39

Patterns Of Care, Costs And Outcomes Of Chest Pain Patients Within Two Years Of Initial Visits To The ER

Abbass, I.M., Virani, S.S., Parikh, R., Taychakhoonavudh, S., Ganduglia, C., Franzini, L.

Journal:

Value in Health

Year:

2013

Language:

english

File:

PDF, 68 KB

english, 2013

40

Effects of nitrogen source and level on the performance of chicks and rats fed low and high tannin sorghum

Rogler, J.C., Ganduglia, H.R.R., Elkin, R.G.

Journal:

Nutrition Research

Year:

1985

Language:

english

File:

PDF, 489 KB

english, 1985

41

Insight into the Adsorption of Water on the Clean CeO 2 (111) Surface with van der Waals and Hybrid Density Functionals

Fernández-Torre, Delia, Kośmider, Krzysztof, Carrasco, Javier, Ganduglia-Pirovano, M. Verónica, Pérez, Rubén

Journal:

The Journal of Physical Chemistry C

Year:

2012

Language:

english

File:

PDF, 3.16 MB

english, 2012

42

Crystal Structure and Vibrational Spectra of AlVO 4 . A DFT Study

Brázdová, Veronika, Ganduglia-Pirovano, M. Verónica, Sauer, Joachim

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 445 KB

english, 2005

43

Vanadia and Water Coadsorption on Tetragonal Zirconia Surfaces

Hofmann, Alexander, Ganduglia-Pirovano, M. Verónica, Sauer, Joachim

Journal:

The Journal of Physical Chemistry C

Year:

2009

Language:

english

File:

PDF, 4.96 MB

english, 2009

44

Vanadium Oxides on Aluminum Oxide Supports. 2. Structure, Vibrational Properties, and Reducibility of V 2 O 5 Clusters on α-Al 2 O 3 (0001)

Brázdová, Veronika, Ganduglia-Pirovano, M. Verónica, Sauer, Joachim

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 921 KB

english, 2005

45

Periodic Density Functional Theory Study of VO n Species Supported on the CeO 2 (111) Surface

Popa, Cristina, Ganduglia-Pirovano, María Verónica, Sauer, Joachim

Journal:

The Journal of Physical Chemistry C

Year:

2011

Language:

english

File:

PDF, 5.48 MB

english, 2011

46

Vanadia Aggregates on an Ultrathin Aluminum Oxide Film on NiAl(110)

Brázdová, Veronika, Ganduglia-Pirovano, M. Verónica, Sauer, Joachim

Journal:

The Journal of Physical Chemistry C

Year:

2010

Language:

english

File:

PDF, 5.41 MB

english, 2010

47

Vanadium Oxides on Aluminum Oxide Supports. 3. Metastable κ-Al2O3(001) Compared to α-Al2O3(0001)

Todorova, T.K., Ganduglia-Pirovano, M.V., Sauer, J.

Journal:

The Journal of Physical Chemistry C

Year:

2007

Language:

english

File:

PDF, 956 KB

english, 2007

48

Role of Ceria in Oxidative Dehydrogenation on Supported Vanadia Catalysts

Ganduglia-Pirovano, Maria Veronica, Popa, Cristina, Sauer, Joachim, Abbott, Heather, Uhl, Alexander, Baron, Martin, Stacchiola, Dario, Bondarchuk, Oleksandr, Shaikhutdinov, Shamil, Freund, Hans-Joachi

Journal:

Journal of the American Chemical Society

Year:

2010

Language:

english

File:

PDF, 1.33 MB

english, 2010

49

Reduction of the (001) Surface of γ-V 2 O 5 Compared to α-V 2 O 5

Ganduglia-Pirovano, M. Veronica, Sauer, Joachim

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 583 KB

english, 2005

50

Counting Electrons Transferred through a Thin Alumina Film into Au Chains

Nilius, N., Ganduglia-Pirovano, M. V., Brázdová, V., Kulawik, M., Sauer, J., Freund, H.-J.

Journal:

Physical Review Letters

Year:

2008

Language:

english

File:

PDF, 960 KB

english, 2008