Senftle, Thomas P.: search on Z-Library

The world's largest scientific articles store. 70,000,000+ articles for free.

1

Development of a ReaxFF potential for Pd∕O and application to palladium oxide formation

Senftle, Thomas P., Meyer, Randall J., Janik, Michael J., van Duin, Adri C. T.

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 3.66 MB

english, 2013

2

Methane Activation at the Pd/CeO 2 Interface

Senftle, Thomas P., van Duin, Adri C. T., Janik, Michael J.

Journal:

Year:

2017

Language:

english

File:

PDF, 2.31 MB

english, 2017

3

First-principles-guided design of ionic liquids for CO2 capture

Wu, Chao, Senftle, Thomas P., Schneider, William F.

Journal:

Physical Chemistry Chemical Physics

Year:

2012

Language:

english

File:

PDF, 1.88 MB

english, 2012

4

Interaction of Pyridine and Water with the Reconstructed Surfaces of GaP(111) and CdTe(111) Photoelectrodes: Implications for CO 2 Reduction

Senftle, Thomas P., Lessio, Martina, Carter, Emily A.

Journal:

Chemistry of Materials

Year:

2016

Language:

english

File:

PDF, 2.43 MB

english, 2016

5

The Role of Surface-Bound Dihydropyridine Analogues in Pyridine-Catalyzed CO 2 Reduction over Semiconductor Photoelectrodes

Senftle, Thomas P., Lessio, Martina, Carter, Emily A.

Journal:

ACS Central Science

Year:

2017

Language:

english

File:

PDF, 1.53 MB

english, 2017

6

Hydride Shuttle Formation and Reaction with CO2 on GaP(110)

Lessio, Martina, Senftle, Thomas P., Carter, Emily Ann

Journal:

Year:

2018

Language:

english

File:

PDF, 1.19 MB

english, 2018

7

Is the Surface Playing a Role during Pyridine-Catalyzed CO 2 Reduction on p-GaP Photoelectrodes?

Lessio, Martina, Senftle, Thomas P., Carter, Emily A.

Journal:

ACS Energy Letters

Year:

2016

Language:

english

File:

PDF, 1.29 MB

english, 2016

8

Determining in situ phases of a nanoparticle catalyst via grand canonical Monte Carlo simulations with the ReaxFF potential

Senftle, Thomas P., van Duin, Adri C.T., Janik, Michael J.

Journal:

Catalysis Communications

Year:

2014

Language:

english

File:

PDF, 2.88 MB

english, 2014

9

The ReaxFF reactive force-field: development, applications and future directions

Senftle, Thomas P, Hong, Sungwook, Islam, Md Mahbubul, Kylasa, Sudhir B, Zheng, Yuanxia, Shin, Yun Kyung, Junkermeier, Chad, Engel-Herbert, Roman, Janik, Michael J, Aktulga, Hasan Metin, Verstraelen,

Journal:

npj Computational Materials

Year:

2016

Language:

english

File:

PDF, 5.21 MB

english, 2016

10

A ReaxFF Investigation of Hydride Formation in Palladium Nanoclusters via Monte Carlo and Molecular Dynamics Simulations

Senftle, Thomas P., Janik, Michael J., van Duin, Adri C. T.

Journal:

The Journal of Physical Chemistry C

Year:

2014

Language:

english

File:

PDF, 2.30 MB

english, 2014

11

Using statistical learning to predict interactions between single metal atoms and modified MgO(100) supports

Liu, Chun-Yen, Zhang, Shijia, Martinez, Daniel, Li, Meng, Senftle, Thomas P.

Journal:

npj Computational Materials

Year:

2020

File:

PDF, 4.81 MB

2020

12

Charge Transfer Stabilization of Late Transition Metal Oxide Nanoparticles on a Layered Niobate Support

Strayer, Megan E., Senftle, Thomas P., Winterstein, Jonathan P., Vargas-Barbosa, Nella M., Sharma, Renu, Rioux, Robert M., Janik, Michael J., Mallouk, Thomas E.

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.92 MB

english, 2015

13

Interaction trends between single metal atoms and oxide supports identified with density functional theory and statistical learning

O’Connor, Nolan J., Jonayat, A. S. M., Janik, Michael J., Senftle, Thomas P.

Journal:

Nature Catalysis

Year:

2018

Language:

english

File:

PDF, 2.97 MB

english, 2018

14

Influence of Hydroxyls on Pd Atom Mobility and Clustering on Rutile TiO 2 (011)-2 × 1

Addou, Rafik, Senftle, Thomas P., O’Connor, Nolan, Janik, Michael J., van Duin, Adri C.T., Batzill, Matthias

Journal:

Year:

2014

Language:

english

File:

PDF, 992 KB

english, 2014

15

Illuminating surface atoms in nanoclusters by differential X-ray absorption spectroscopy

Spanjers, Charles S., Senftle, Thomas P., van Duin, Adri C. T., Janik, Michael J., Frenkel, Anatoly I., Rioux, Robert M.

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.35 MB

english, 2014

16

The Role of Site Stability in Methane Activation on PdxCe1-xOδ Surfaces

Senftle, Thomas P, van Duin, Adri C.T., Janik, Michael J.

Journal:

Year:

2015

Language:

english

File:

PDF, 2.17 MB

english, 2015

17

Growth of Stable Surface Oxides on Pt(111) at Near-Ambient Pressures

Fantauzzi, Donato, Krick Calderón, Sandra, Mueller, Jonathan E., Grabau, Mathias, Papp, Christian, Steinrück, Hans-Peter, Senftle, Thomas P., van Duin, Adri C. T., Jacob, Timo

Journal:

Angewandte Chemie

Year:

2017

Language:

english

File:

PDF, 2.93 MB

english, 2017

18

Variation in In 2 O 3 Crystal Phase Alters Catalytic Performance toward the Reverse Water Gas Shift Reaction

Wang, Jianyang, Liu, Chun-Yen, Senftle, Thomas P., Zhu, Jie, Zhang, Guanghui, Guo, Xinwen, Song, Chunshan

Journal:

Year:

2019

Language:

english

File:

PDF, 760 KB

english, 2019

19

Growth of Stable Surface Oxides on Pt(111) at Near-Ambient Pressures

Fantauzzi, Donato, Krick Calderón, Sandra, Mueller, Jonathan E., Grabau, Mathias, Papp, Christian, Steinrück, Hans-Peter, Senftle, Thomas P., van Duin, Adri C. T., Jacob, Timo

Journal:

Angewandte Chemie International Edition

Year:

2017

Language:

english

File:

PDF, 2.13 MB

english, 2017

20

Understanding the effects of Cd- and Ag-doping in Cu2ZnSnS4 solar cells

Sai Gautam, Gopalakrishnan, Senftle, Thomas P., Carter, Emily A.

Journal:

Chemistry of Materials

Year:

2018

Language:

english

File:

PDF, 1.55 MB

english, 2018

21

Mechanistic Insights into pH-controlled Nitrite Reduction to Ammonia and Hydrazine over Rhodium

Clark, Chelsea A., Reddy, C. Prakash, Xu, Hao, Heck, Kimberly, Luo, Guohua, Senftle, Thomas P., Wong, Michael S.

Journal:

Year:

2019

File:

PDF, 1.40 MB

2019

22

The Holy Grail: Chemistry Enabling an Economically Viable CO 2 Capture, Utilization, and Storage Strategy

Senftle, Thomas P., Carter, Emily A.

Journal:

Accounts of Chemical Research

Year:

2017

Language:

english

File:

PDF, 1.60 MB

english, 2017

23

Density Functional Theory Modeling of Photo-electrochemical Reactions on Semiconductors: H 2 Evolution on 3C-SiC

Bhati, Manav, Chen, Yu, Senftle, Thomas P.

Journal:

The Journal of Physical Chemistry C

Year:

2020

File:

PDF, 4.17 MB

2020

24

Reaction Mechanism Governing Formation of 1,3-Bis(diphenylphosphino)propane-Protected Gold Nanoclusters

Hudgens, Jeffrey W., Pettibone, John M., Senftle, Thomas P., Bratton, Ryan N.

Journal:

Inorganic Chemistry

Year:

2011

Language:

english

File:

PDF, 1.64 MB

english, 2011

25

Novel Solar Cell Materials: Insights From First Principles

Sai Gautam, Gopalakrishnan, Senftle, Thomas P., Alidoust, Nima, Carter, Emily A.

Journal:

The Journal of Physical Chemistry C

Year:

2018

Language:

english

File:

PDF, 2.04 MB

english, 2018

26

Variation in In 2 O 3 Crystal Phase Alters Catalytic Performance toward the Reverse Water Gas Shift Reaction

Wang, Jianyang, Liu, Chun-Yen, Senftle, Thomas P., Zhu, Jie, Zhang, Guanghui, Guo, Xinwen, Song, Chunshan

Journal:

Year:

2019

File:

PDF, 760 KB

2019

27

Theoretical Determination of Band Edge Alignments at the Water-CuInS2(112) Semiconductor Interface

Senftle, Thomas P., Carter, Emily A.

Journal:

Year:

2017

Language:

english

File:

PDF, 1.99 MB

english, 2017

28

Efficient Photocatalytic PFOA Degradation over Boron Nitride

Duan, Lijie, Wang, Bo, Heck, Kimberly, Guo, Sujin, Clark, Chelsea A., Arredondo, Jacob, Wang, Minghao, Senftle, Thomas P., Westerhoff, Paul, Wen, Xianghua, Song, Yonghui, Wong, Michael S.

Journal:

Environmental Science & Technology Letters

Year:

2020

File:

PDF, 4.12 MB

2020

To build up a library is to create a life. It’s never just a random collection of books.

— Carlos María Domínguez

Official channel

Z-Library Desktop Launcher

Z-Library Since 2009 support@1delivery.pm

EnglishРусскийEspañolItalianoελληνικάاللغة العربيةBahasa IndonesiaBahasa Malaysiaहिन्दीDeutschFrançaisPortuguêsУкраїнськаPolski中文繁體中文日本語Tiếng ViệtAzərbaycan DiliՀայոց լեզուภาษาไทยTürk Diliქართველიবাংলাپښتوతెలుగుاردو한국어SrpskiБългарски