Bill Schneider

Dr. Schneider

Professor, Chemical and Biomolecular Engineering
Concurrent Professor, Chemistry and Biochemistry
Asoc. Director, Center for Sustainable Energy at Notre Dame
Sr. Editor, Journal of Physical Chemistry
University of Notre Dame

Office: 123b Cushing Hall
Mailing: 182 Fitzpatrick Hall, Notre Dame, Indiana, 46556
Email: wschneider@nd.edu
Phone: (574) 631-8754
Fax: (574) 631-8366

CV Family

Group offices: 150 Fitzpatrick Hall

People
Dorrell McCalman

Dr. Dorrell McCalman

Post Doc
Chemical and Biomolecular Engineering
150 E Fitzpatrick Hall
574-631-1427
dmccalma@nd.edu

Aqueous nitrate hydrogenation catalysis


John Clay

John Clay

Graduate Student
Chemical and Biomolecular Engineering
150 E Fitzpatrick Hall
574-631-1427
jclay@nd.edu

Water-gas shift modeling


Mike Penninger

Mike Penninger

Graduate Student
Chemical and Biomolecular Engineering
150 E Fitzpatrick Hall
574-631-1427
mpennin1@nd.edu

Oxides for catalytic NO oxidation


Atun Anggara

Atun Anggara

Graduate Student
Chemical and Biomolecular Engineering
150 J Fitzpatrick Hall
574-631-1437
tanggara@nd.edu

NOx Selective Catalytic Reductions


Sonia Antony

Dr. Sonia Antony

Post. Doc. Associate
Chemical and Biomolecular Engineering
150 I Fitzpatrick Hall
574-631-1456
santony1@nd.edu

CO2 reduction catalysts


Laura Herder

Laura Herder

Graduate Student
Chemistry and Biochemistry
150 C Fitzpatrick Hall
574-631-1424
lherder@nd.edu

Coverage effects of adsorbates


Taebum Lee

Dr. Taebum Lee

Post. Doc. Associate
Chemical and Biomolecular Engineering
150 E Fitzpatrick Hall
574-631-1427
tlee8@nd.edu

Ionic Liquids


Chris Paolucci

Chris Paolucci

Graduate Student
Chemical and Biomolecular Engineering
150 J Fitzpatrick Hall
574-631-1437
cpaolucc@nd.edu

NOx Selective Catalytic Reductions


Chris Paolucci

Dr. Katie Maerzke

Post-Doc
Chemical and Biomolecular Engineering
150 L Fitzpatrick Hall
574-631-3955
kmaerzke@nd.edu


Houyu Zhu

Dr. Houyu Zhu

Post. Doc. Associate
Chemical and Biomolecular Engineering
150 E Fitzpatrick Hall
574-631-1427
hzhu3@nd.edu

Water-gas shift modeling


Quintin Sheridan

Quintin Sheridan

Graduate Student
Chemical and Biomolecular Engineering
150 Fitzpatrick Hall
574-631-1528
qsherida@nd.edu


Steven McDonough

Steven McDonough

Graduate Student
Chemical and Biomolecular Engineering
150 J Fitzpatrick Hall
574-631-1528
smcdono1@nd.edu


Kurt Frey

Dr. Kurt Frey

Post-Doc
Chemical and Biomolecular Engineering
150 L Fitzpatrick Hall
419-202-4176
mesokurtic@nd.edu

Cluster expansions of surface reactions


Anshumaan Bajpai

Anshumaan Bajpai

Graduate Student
Chemical and Biomolecular Engineering
150 C Fitzpatrick Hall
574-631-1424
abajpai@nd.edu

Cluster expansions of surface reactions


Solomon Assefa

Solomon Assefa

Graduate Student
Chemical and Biomolecular Engineering
150 C Fitzpatrick Hall
574-631-1424
sassefa@nd.edu

Cluster expansions of surface reactions


Hui Li

Hui Li

Graduate Student
Chemical and Biomolecular Engineering
150 J Fitzpatrick Hall
574-631-1437
hli8@nd.edu

NOx Selective Catalytic Reductions


Kate Bowie

Kate Bowie

Undergraduate
Chemical and Biomolecular Engineering
2015 Notre Dame
kbowie1@nd.edu

>Metal-oxide interfaces


Pat Connelly

Pat Connelly

Undergraduate
Chemical and Biomolecular Engineering
2015 Notre Dame
pconnell2@nd.edu

Zeolite catalyst models


Sean Dwyer

Sean Dwyer

Undergraduate
Chemical and Biomolecular Engineering
2015 Notre Dame
sdwyer4@nd.edu

Ionic liquids modeling


Group Photo
Group Meeting Schedule
Ph. D. Alumni
Jason Bray

Dr. Jason Bray
CBE Ph.D., 2013
Phillips 66

Dorrell McCalman

Dr. Dorrell McCalman
CBE Ph.D., 2013
Notre Dame

David Schmidt

Dr. David Schmidt
CBE Ph.D., 2012
Ceres Inc.

Elaine Mindrup

Dr. Elaine Mindrup
CBE Ph.D., 2011
Columbia Law School

Hangyao Wang

Dr. Hangyao Wang
CBE Ph.D., 2009
Dow Chemical Company

Rachel Getman

Dr. Rachel Getman
CBE Ph.D., 2009
Asst. Prof., Clemson U.

M.Sc. Alumni
Alumni Information Current Affiliation Thesis Title

Michelle Morton

Chemistry M.Sc., 2013 Effects of Nitrogen Based Anions on CO2 Binding and Proton Affinity

Mandy Danser

Chemistry M.Sc., 2011 New Jersey Police Department Beyond the gas phase: towards modeling bulk ionic liquids with a comparison of Density Functional Tight Binding (DFTB) to Density Functional Theory (DFT)

Mr. Wenguang Lin

Chemistry M.Sc., 2009 Notre Dame Business School DFT Simulations of Re3 Cluster Catalysts
Undergrad alumni
Alumni Information Current Affiliation Thesis Title

Ryan Anderson

Undergrad research
2012-2013
Cu dimers in SSZ-13 catalysts

Mark Sullivan

Undergrad research
2011-2012
University of Minnesota school Carbenes for CO2 capture

Jennifer Smith

Undergrad research
2011-2012
ExxonMobil XPS of oxygen on Pt

Allison Hamman

Undergrad research
2011-2012
Phase change ionic liquids

Jonathan Conway

Undergrad research
2009-2010
NC State graduate school Adsorbate-adsorbate electronic interaction modeling

Thomas Senftle

Undergrad research
2009-2010
Penn. State grad. school AHA Ionic Liquids for CO2 capture

Martin Beres

Undergrad research
2009-2010
Ohio State U. grad. school Cluster expansions of surface adsorption

Shawn Coleman

Undergrad research
2007-2009
U. Arkansas grad. school Metal cluster calculations

Nate Menendez

Undergrad. research
2008-2009
Air Products DFT calculations of NDMA decomposition

Danny Beyrer

Undergrad. research
Summer 2008
Rose-Hulman NO adsorption on Pd and Pd alloys

Miriam Shakalli Tang

Undergrad. research
Summer 2008
Ohio State University Some title

Jessica Nadai

Undergrad. researcher
2006-2007
BP DFT Calculations of Oxygen Adsorption on Gold, Iridium, and Nickel

Josh Bruce

Undergrad. research
2006-2007
Travelers Cl Atom Reactions with iso-Propanol
Former Post-Docs
Alumni Information Current Affiliation Thesis Title

Dr. Jean-Sabin McEwen

Research Scientist, 2011-2012 Chemical Enginnering faculty, Washington State University

Dr. Chao Wu

Research Scientist, 2009-2012 Chemistry faculty, Xi'an Jiaotong University

Dr. ZhengZheng Chen

Post-doc, 2010-2011 UCLA

Dr. Bhabani Mallik

Post-doc, 2010-2011 IIT Hyderabad - India

Dr. Hannah Fox

Post-doc, 2009-2010

Dr. Victor Ranea

Visiting scientist, 2006-2009 Conicet Argentina

Dr. Abhijit Phatak

Post-doc, 2007-2008 Intel Corp.

Dr. Li Xiao

Post-doc, 2006-2007 Accelrys Corp.

Dr. Ye Xu

Post-doc, 2004-2005 Oak Ridge National Lab

Available research positions