CONFERENCE CATALOGUE ON ADVANCED VIBRATIONAL SPECTROSCOPY - 11TH INTERNATIONAL CONFERENCE - ICAVS 11
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11th International Conference
on ADVANCED VIBRATIONAL SPECTROSCOPY
23rd-26th August 2021 / ONLINE
CONFERENCE CATALOGUE
Organizers:
Jagiellonian University Raman Imaging Group (ZOR),
in Krakow Faculty of Chemistry
The International Society Targi w Krakowie Ltd.
for Clinical Spectroscopy
Table of Contents
Organizers . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2
Welcome . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 4
Committees . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5
Jagiellonian University . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7
CLIRSPEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 8
Conference Secretariat . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 8
Sponsors . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 9
History of ICAVS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10
ICAVS11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 12
Spectrochimica Acta A . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13
Online conference platform . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 14
Programme at glance . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15
Detailed programme . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 19
Let’s meet our Sponsors! . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39
3
Welcome
We are delighted to invite you to the 11th International Conference on Advanced Vibrational Spectroscopy (ICAVS 11)
scheduled between 23rd to 26th August 2021.
ICAVS Conferences have a well-established tradition and rich history. The ICAVS 11 conference is being organized by
the Raman Imaging Group, together with Jagiellonian University and the International Society for Clinical Spectroscopy.
However, the origins of the conference organization date back to 1970, when the first meeting of the International Con-
ference on Fourier Transform Spectroscopy (ICOFTS) was held in Aspen, USA. Since then, it was continued and took place
every two years all around the globe until it attained its current name, the International Conference on Advanced Vibra-
tional Spectroscopy, in 2001. In 2021, after more than 50 years since the first summit, we meet together for the first time
in exceptional circumstances because the conference is organized virtually. The opportunity for all of us to meet online,
no matter where we are in the world, is a sign of our times. Despite the fact that we will not be able to meet in person
and over a cup of coffee exchange ideas for new groundbreaking research and discuss the results obtained of recently
performed experiments, we are certain that the online form of the meeting will not diminish the scientific value of the
conference. Thanks to the lectures of distinguished researchers invited as keynote speakers, oral presentations, and post-
ers submitted in the form of flash presentations, which were carefully selected by the Scientific Committee, we believe
that the upcoming few days will be scientifically informative and productive. In addition, dedicated time for debate will
enable a fruitful exchange of opinions between scientists from multiple countries participating in the conference.
The conference will be focused on recent advances in vibrational spectroscopy with an emphasis on the development
of new experimental methods and applications of selected spectroscopic techniques to research in a wide variety of
fields, including analytical techniques in the industry, biomedical applications, drug delivery monitoring, life sciences,
cultural heritage, forensic sciences, and nanomaterials. Particular sessions will be dedicated, among all, to plasmonics
and near-field nanospectroscopy, non-linear vibrational spectroscopy, multimodal spectroscopic imaging, Brillouin and
chiroptical spectroscopy, multivariate data analysis and applications of artificial intelligence, and machine learning in
spectroscopic data treatment. The meeting will be thus very attractive for experts who would like to share innovative
ideas and for young scientists who want to broaden their knowledge and discuss the results of their research.
We are very pleased to meet you all at the ICAVS 11, a great place to grow, stimulate academic development and
broaden horizons of the application of vibrational spectroscopy in science.
Yours faithfully,
Prof. Katarzyna M. Marzec
Prof. Malgorzata Baranska
Jagiellonian University
Jagiellonian University
in Krakow
in Krakow
ICAVS 11 Co–chair
ICAVS 11 Chair
Local Organising Committee
Prof. Kamilla Malek
Jagiellonian University Prof. Sergei Kazarian
in Krakow Imperial Collage London
ICAVS 11 Co–chair ICAVS 11 Program Chair
Local Scientific Committee
4
Committees
Chair: Malgorzata Baranska (Jagiellonian University in Krakow)
Co–chair (Local Scientific Committee): Kamilla Malek (Jagiellonian University in Krakow)
Co–chair (Local Organising Committee): Katarzyna M. Marzec (Jagiellonian University in Krakow)
International Steering Committee
Bernhard Lendl (Austria 2021) TU Wien
Michael George (UK 2021) University of Nottingham
Alexandre Brolo (Canada 2023) University of Victoria
Dennis Hore (Canada 2023) University of Victoria
Keith Gordon (New Zealand 2025) University of Otago
Ian Lewis (USA 2025) Kaiser Optical Systems, Inc.
Malgorzata Baranska (Poland 2027) Jagiellonian Univeristy in Krakow
Sergei Kazarian (UK 2027) Imperial College London
Bin Ren (China 2027) Xiamen University
Program Committee
Chair of program committee: Sergei Kazarian – Imperial College London, UK
Baker Matthew University of Strathclyde UK
Brolo Alexandre University of Victoria Canada
Centrone Andrea NIST USA
Domke Katrin Max Planck Institute for Polymer Research Germany
Fujita Katsumasa Osaka University Japan
George Michael University of Nottingham USA
Halas Naomi Rice University USA
Hasegawa Takeshi Kyoto University Japan
Hobro Alison Osaka University Japan
Huck Christian University of Innsbruck Austria
Jung Young Mee Kangwon National University Korea
Kendall Catherine Gloucestershire Royal Hospital USA
Kneipp Janina Humboldt-University in Berlin Germany
Lewis Ian R. Kaiser Optical Systems Inc. USA
Manley Marena Stellenbosch University South Africa
Marcott Curt Light Light Solutions USA
Morikawa Junko Tokyo Institute of Technology Japan
Pellerin Christian University of Montreal Canada
Pucci Annemarie Heidelberg University Germany
Ren Bin Xiamen University China
Sato Harumi Kobe University Japan
Schlücker Sebastian University of Duisburg-Essen Germany
Sitarz Maciej AGH University of Science and Technology Poland
Vanholsbeeck Frederique The University of Auckland New Zealand
Wood Bayden R. Monash University-CLIRSPEC Australia
Zachary D. Schultz Ohio State University USA
Zanni Martin University of Wisconsin USA
Zhao Bing Jilin University China
5
Local Scientific Committee
Baranska Malgorzata Jagiellonian University in Krakow Poland
Brozek–Pluska Beata Lodz University of Technology Poland
Czarnecki Miroslaw Univeristy of Wroclaw Poland
Chwiej Joanna G. AGH University of Science and Technology Poland
Dobrowolski Jan Cz. Institute of Nuclear Chemistry and Technology Poland
Gil Barbara Jagiellonian University in Krakow Poland
Gruszecki Wieslaw I. Maria Curie-Sklodowska University in Lublin Poland
Hetmanczyk Lukasz Jagiellonian University in Krakow Poland
Kudelski Andrzej University of Warsaw Poland
Kwiatek Wojciek M. Institute of Nuclear Physics of the Polish Academy of Sciences Poland
Malek Kamilla Jagiellonian University in Krakow Poland
Weselucha–Birczynska Aleksandra Jagiellonian University in Krakow Poland
Local Organizing Committee
Jagiellonian University in Krakow, Poland
Malgorzata Baranska Halat Monika
Kamilla Malek Kaczmarska Magdalena
Katarzyna M. Marzec Majzner Katarzyna
Borkowska Anna Matuszyk Ewelina
Brzozowski Krzysztof Pacia Marta
Bulat Katarzyna Wiercigroch Ewelina
Chrabaszcz Karolina Wislocka Adrianna
Czamara Krzysztof Zajac Grzegorz
Dybas Jakub
International Advisors
Mahadevan–Jansen Anita Vanderbilt School of Engineering USA
Abramczyk Halina Technical University of Lodz Poland
Bhargava Rohit University of Illinois USA
Byrne Hugh J. FOCAS Institute of the Dublin Institute of Technology Ireland
Choo Jaebum Chung-Ang University Korea
Furukawa Yukio Waseda University Japan
Lednev Igor University at Albany State USA
Lendl Bernhard TU Wien Austria
Ozaki Yukihiro Kwansei Gakuin University Japan
Polavarapu Prasad Vanderbilt University USA
Popp Jürgen University of Jena Germany
Smulevich Giulietta University of Florence Italy
Tian Zhong-Qun Xiamen University China
Vaccari Lisa ELETTRA Sincrotrone Trieste Italy
Waluk Jacek Institute of Physical Chemistry of the Polish Academy of Science Poland
CLIRSPEC Representatives
Byrne Hugh FOCAS Institute, Technological University of Dublin Ireland
Henderson Alex University of Manchester UK
6
Jagiellonian University
The Jagiellonian University (UJ) was founded over 650 years ago on the
12th of May 1364 by the Polish king Casimir the Great – which makes it the
oldest higher education institution in Poland and one of the oldest in Eu-
rope. Some of the major historical figures, including world famous schol-
ars, such as Nicolaus Copernicus or Karol Olszewski, as well as Karol Wo-
jtyła, the future Pope John Paul II, have taken an honorary place among
the university’s graduates. Located in the historic city of Krakow – the for-
mer capital of Poland and a great cultural and tourist centre, Jagiellonian
University has been an international scientific unit ever since its very beginning. Poles, Ruthenians, Lithuanians,
Hungarians, Germans, Czechs, the Swiss, the English, the Dutch, the French, the Spanish, Italians, and even Tatars
studied here in the old days.
Today, the Jagiellonian University is involved in
various international cooperation activities, in-
cluding research and educational projects, facul-
ty and student exchanges within bilateral agree-
ments, Erasmus+ and SYLFF, summer schools,
networks, innovation, and technology transfer
as well as different scholarship schemes, during
which young researchers pursue their academic
interests and develop friendships with people
who share their passion. The structure of UJ con-
sists of 16 Faculties, where nearly 4 thousand aca-
demic staff conduct research and provide educa-
tion to almost 40 thousand students, within the
framework of more than 150 different fields of
study. The eminent researchers and state-of-the-
art infrastructure make the UJ one of the leading
Polish scientific institutions, which also is wide-
ly recognized through research achievements.
The current position of the UJ is also reflected in
the growing number of patent applications and
patents. Additionally, the University was also rec-
ognized by the international databases Web of
Science and Elsevier Scopus as possessing the
most prolific researchers in Poland, publishing
the most academic papers. In 2018, it was the
only Polish and Eastern European higher edu-
cation institution in Reuter’s Top 100: Europe’s
Most Innovative Universities ranking. At the end
of 2020, several dozen UJ researchers have been
announced as the TOP 2% of the best scientists
in the world based on the ranking prepared by
Stanford University in cooperation with Elsevier
and SciTech Strategies company.
7
CLIRSPEC
Over the years, spectroscopy has become a successful and well-established tool in the in-
vestigation of cells, tissues, and other biological materials. This has driven efforts to translate
spectroscopy into the fields of clinical and pharmacological applications. In order to help
co-ordinate efforts globally, the International Society for Clinical Spectroscopy (CLIRSPEC)
was established, as a non-profit organization, in 2015. CLIRSPEC is the platform for individ-
ual researchers, teams, and organizations wishing to promote new solutions for clinicians
to improve the patient diagnosis and disease prognosis. CLIRSPEC welcomes anyone inter-
ested in the translation of molecular spectroscopic techniques, in particular Infrared and
Raman spectroscopy, into the clinical arena.
Conference Secretariat
Targi w Krakowie Ltd. is the largest organizer of conferences, congresses, and fairs in the south
of Poland and the third in the country. The company has been organizing the most important
industry events for over 25 years. We are proudly a member of ICCA and UFI.
PCO & DMC Department of the company has an experience in organizing international con-
gresses for thousands of participants as well as in smaller and low-keyed events for several dozen
persons. Our events are taking place in different attractive locations in Krakow and throughout
Poland, depending on the clients needs. We provide full service in organizing events, always tailored to your expec-
tations. We offer comprehensive organization of the event or we can deal with only chosen aspects of the event as
well (organisational support, registration and invoicing, event promotion, accompanying and tourist programme,
exhibitions and poster sessions, and many more).
Targi w Krakowie Ltd. is the exclusive owner and operator of The International Exhibition and
Convention Centre EXPO Krakow. EXPO Krakow was opened in 2014 and was created with
the needs of the organisers of all kinds of different events. The main advantage of this facility is
its multifunctional character. The large (14,000 sq. m) open space includes two halls of 4,000 and
5,000 sqm respectively. The exhibition hall can be transformed into an auditorium which can accommodate up to
5,000 people. EXPO Krakow also includes a number of air-conditioned, modular conference rooms, a spacious lobby,
and a restaurant.
Comprehensive and professional customer service and support from the Technical Department at each stage of
operation guarantee success to all the parties involved. We value original ideas and experiences. Every project is pos-
sible – we are only limited by imagination!
8
Sponsors
PLATINIUM
GOLD
9
History of ICAVS
The beginning of the ICAVS meetings dates back to the 70s and stemmed from two other conferences: the International
Conference on Fourier Transform Spectroscopy (ICOFTS) and the Advanced Infrared Spectroscopy (AIRS). The first one,
ICOFTS, began in 1970 in Aspen, USA and continued in 1977 and 1981 in South Carolina, USA. Following 1981, ICOFTS
became a biennial conference. The first meeting outside the USA was held in Durham, UK and meetings continued to
run at locations around the globe. The latter, AIRS, had its beginning in 1993 in Tokyo, Japan as a special conference and
was originally not intended to be a series. However, the next AIRS meetings took place in North Carolina, USA (1996) and
Vienna, Austria (1998). Both conferences helped to shape the present form of the ICAVS conference.
In the late 1990s, to bring scientists together it was decided to join these meetings and establish one conference enti-
tled the International Conference on Advanced Vibrational Spectroscopy (ICAVS). The first one of the ICAVS meetings
was held in 2001 in Turku, Finland and continues as a biennial conference moving throughout the world. The ICAVS
conference rotates among the continents, with ICAVS7 held in Japan (2013), ICAVS8 in Austria (2015), ICAVS9 in Can-
ada (2017), and ICAVS10 in New Zealand (2019).
Each ICAVS event gathers between 450-700 participants from all over the world, including UK, Australia, New Zea-
land, South Korea, Poland, India, Austria, Canada, USA, Germany, Japan, France, China, and Brazil. For the first time in
the history of ICAVS, this event will be virtual in 2021 due to the worldwide coronavirus pandemic.
2001
2017 2003
2005 2015 2021
2007
2011 2013
2019
2009
10Conference Year Location Chair Program Chair
ICAVS1 2001 Turku, Finland Jyrki Kauppinnen Matti Hotokka
ICAVS2 2003 Nottingham, UK Michael George John Chalmers
ICAVS3 2005 Wisconsin, USA Larry Nafie and Rina Dukor
ICAVS4 2007 Corfu, Greece Vasilius Gregariou Bernhard Lendl
ICAVS5 2009 Melbourne, Australia Donald McNaughton Bayden Wood
ICAVS6 2011 California, USA James de Haseth Curtis Marcott
ICAVS7 2013 Kobe, Japan Yukihiro Ozaki Taskeshi Hasegawa
ICAVS8 2015 Vienna, Austria Bernhard Lendl Michael George
ICAVS9 2017 Victoria, Canada Alexandre Brolo Dennis Hore
ICAVS10 2019 Auckland, New Zealand Keith Gordon Ian R. Lewis and Cushla McGoverin
and Frédérique Vanholsbeeck
ICAVS11 2021 Krakow, Poland Malgorzata Baranska, Kamilla Malek Sergei Kazarian
and Katarzyna M. Marzec
11ICAVS11
Since 2001 the International Conference on Advanced Vibrational Spectroscopy (ICAVS) brings together leading re-
searchers, applications scientists, clinicians, and engineers focused on advances In a wide range of spectroscopic
techniques. ICAVS 2021 is the 11th conference in the successful ICAVS series, providing afresh a unique occasion to
discuss about recent discoveries, new trends, and directions related mainly to infrared and Raman spectroscopies as
well as to exchange knowledge and ideas in this field of science.
We made together every effort to create a remarkable program that continues tradition of inspiring scientific meet-
ings. As previous, this year ICAVS is particularly focused on development of spectroscopic methods and their interdis-
ciplinary applications. The line-up of ten plenary speakers includes experts from United Kingdom, Switzerland, Ger-
many, Poland, China, Japan, USA, Canada, and Australia. Conference program will span talks over 60 invited speakers
focused on cutting-edge science in the following subject areas:
APPLICATIONS DEVELOPMENT
Analytical Techniques in Industry Plasmonics
Biomedical Applications Non-Linear Vibrational Spectroscopy
Drug Delivery and Monitoring Near-field Vibrational Spectroscopy
Life and Environmental Sciences Time-Resolved Spectroscopy
Archeology and Cultural Heritage Emerging Techniques
Forensic and Security Sciences Multimodal Spectroscopic Imaging
Material Science and Catalysis Instrumental Development
Nanomaterials and Nanostructures Sensing
Computational Spectroscopy/ Quantum Approach
Chemometrics, Artificial Intelligence and Machine Learning
Photothermal Imaging
Brillouin Spectroscopy
Chiroptical Spectroscopy
A special session – Perspective Lectures – is led by four prominent scientists and summaries the current develop-
ments in their research fields with future perspectives for fundamental techniques of infrared and Raman spectros-
copy. This global event also offers an opportunity for scientific discussion and finding solutions to current challenges
in the field of vibrational spectroscopy during poster sessions.
Among the perspectives, plenary, and invited speakers, there are scientists from 27 countries around the world. It is
worth noting that among the conference speakers, women have a significant contribution and constitute 43% and
40% of the invited and plenary speakers, respectively.
12Spectrochimica Acta A
The conference papers can be published in Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
(SAA) as a virtual issues.
SAA (IF=3.232) is an interdisciplinary journal which spans from basic to applied aspects of optical spectroscopy in
chemistry, medicine, biology, and materials science. The journal publishes original scientific papers that feature
high-quality spectroscopic data and analysis. From the broad range of optical spectroscopies, the emphasis is on
electronic, vibrational or rotational spectra of molecules, rather than on spectroscopy based on magnetic moments.
Topics of particular interest of Spectrochimica Acta Part A include, but are not limited to:
• Spectroscopy and dynamics of bioanalytical, biomedical, environmental, and atmospheric sciences
• novel experimental techniques or instrumentation for molecular spectroscopy
• novel theoretical and computational methods
• novel applications in photochemistry and photobiology
• novel interpretational approaches as well as advances in data analysis based on electronic or vibrational spectroscopy.
13Online conference platform
ICAVS 11 CONFERENCE PLATFORM
For the purposes of organizing the ICAVS 11 Online, a special platform was created: https://icavs11.freexon.pl//
In order to be able to participate in the event, it is necessary to log in to the platform using the e-mail address and
password sent by the Organizer.
Each participant who has registered and the registration fee will receive a link to the platform on which the event
will take place in the e-mail. Each link is assigned to an individual e-mail address (provided by the Participant when
creating an account in the conference registration system (https://icavs.exposupport.pl/en-us/default). Only one
user can use a given link in connection with this it is not possible to share the event with other people.
Each participant will have access to four parallel meeting rooms: Main Room, Green Room, Yellow Room, Red Room),
an additional Flash Presentations Room (where short, 3-minute presentations will be held, which are a virtual form
of poster presentations) and a detailed conference program, virtual stands of our Sponsors, conference catalog and
a book of abstracts in pdf format.
Despite the prevailing conditions related to the SARS-CoV-2 virus pandemic, we would like the Participants of this
year’s, unique edition of ICAVS 11 to have the opportunity to exchange valuable knowledge, develop scientific com-
petences and integrate!
14Programme at glance
Monday, 23rd August 2021
MAIN ROOM
08:00-9:00 Opening Ceremony
9:00-11:05 Plenary session (2h)
Chair: Nick Stone, Kamilla Malek
09:05-9:35 Jeremy Baumberg
09:40-10:10 Janina Kneipp
10:15-10:45 Bayden R. Wood
10:45-10:50 Advertisement of Platinum and Gold Sponsors
10:50-11:05 Discussion (live)
11:05-11:15 Break
11:15-12:30 PARALLEL SESSIONS 1 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
1.1 Plasmonics 1.7. Instrumental Development 2.2. Biomedical Applications
Chair: Yaakov Tischler Chair: Wojciech Kwiatek Chair: Alison Hobro
11:15-11:30 Young Mee Jung 11:15-11:30 Paul Dumas 11:15-11:30 Matthew J. Baker
11:30-11:45 Bin Ren 11:30-11:45 Maria Paula Marques 11:30-11:45 Fiona Lyng
11:45-11:55 Arpad Dusa 11:45-11:55 Konstantinos Bourdakos 11:45-11:55 Markéta Fousková
11:55-12:05 Oleksii Ilchenko 11:55-12:05 Alexander Veber 11:55-12:05 Mikołaj Krysa
12:05-12:15 Marie Svecova 12:05-12:15 Tomasz Wróbel 12:05-12:15 Nicolas Pavillon
12:15-12:35 Discussion (live) 12:15-12:35 Discussion (live) 12:15-12:35 Discussion (live)
12:35-13:00 Lunch Time (25 min)
MAIN ROOM
13:00-14:00 Webinar 1 of Platinum sponsor – Teledyne Princeton Instruments
14:00-14:10 Break
14:10-15:30 PARALLEL SESSIONS 2 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
1.4. Time-Resolved Spectroscopy 1.8. Sensing 2.4. Life and Environmental Sciences
Chair: Siva Umapathy Chair: Jaebum Choo Chair: Airton Abrahao Martin
14:10-14:25 Martina Havenith 14:10-14:25 Angela Lopez-Lorente 14:10-14:25 Halina Abramczyk
14:25-14:40 Tullio Scopigno 14:25-14:40 Claudete Fernandes Pereira 14:25-14:40 Adriana S. Franca
14:40-14:50 Ian Burgess 14:40-14:50 Agata Królikowska 14:40-14:50 Marta Pacia
14:50-15:00 Michael George 14:50-15:00 Nicolae Leopold 14:50-15:00 Andreas Schwaighofer
15:00-15:10 Markus Mangold 15:00-15:10 Ewelina Wiercigroch 15:00-15:10 Anna Sroka-Bartnicka
15:10-15:30 Discussion (live) 15:10-15:30 Discussion (live) 15:10-15:30 Discussion (live)
15:30-15:45 Break
15:45-17:05 PARALLEL SESSIONS 3 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
1.1 Plasmonics 1.2. Non-Linear Vibrational Spectroscopy 1.3. Near-field Vibrational Spectroscopy
Chair: Alexandre Brolo Chair: Dennis Hore Chair: Sebastian Schlücker
15:45-16:00 Katrin Domke 15:45-16:00 Zhiwei Huang 15:45-16:00 Ewelina Lipiec
16:00-16:15 Francois Lagugné-Labarthet 16:00-16:15 Yasuyuki Ozeki 16:00-16:15 Markus Raschke
16:15-16:25 Broislav Hinkov 16:15-16:25 Md Shafiul Azam 16:15-16:25 Hans Bechtel
16:25-16:35 Aurelian John-Herpin 16:25-16:35 Giovanni Batiganani 16:25-16:35 Adrian Cernescu
16:35-16:45 Andrzej Kudelski 16:35-16:45 Harpreet Kaur 16:35-16:45 Tanja Deckert-Gaudig
16:45-17:05 Discussion (live) 16:45-17:05 Discussion (live) 16:45-17:05 Discussion (live)
15Tuesday, 24th August 2021
MAIN ROOM
8:45-9:00 Advertisement of Gold and Platinium Sponsors
09:00-10:20 PARALLEL SESSIONS 4 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
1.10. Chemometrics, Artificial Intelligence and 2.3. Drug Delivery and Monitoring 1.8. Sensing
Machine Learning Chair: Keith Gordon Chair: Maciej Roman
Chair: Christian Huck
09:00-09:15 Thomas Bocklitz 09:00-09:15 David Perez-Guita 09:00-09:15 Hatice Altug
09:15-09:30 Mika Ishigaki 09:15-09:30 Sara J. Miller 09:15-09:30 Boris Mizaikoff
09:30-09:40 Krzysztof Banas 09:30-09:40 Daniela Drescher 09:30-09:40 Maxim Darvin
09:40-09:50 Sae Ishihara 09:40-09:50 Jacek Lipkowski 09:40-09:50 Jakub Dybas
09:50-10:00 Anna Nowakowska 09:50-10:00 Katarzyna Majzner 09:50-10:00 Iskander Usenov
10:00-10:20 Discussion (live) 10:00-10:20 Discussion (live) 10:00-10:20 Discussion (live)
10:20-10:30 Break
10:30-11:50 PARALLEL SESSIONS 5 (1h 20 min)
GREEN ROOM YELLOW ROOM
1.13 Chiroptical spectroscopy 2.5. Archeology and Cultural Heritage
Chair: Monika Hałat Chair: Francesca Rosi
10:30-10:45 Joanna Rode 10:30-10:45 Claudia Conti
10:45-11:00 Masashi Unno 10:45-11:00 Santiago Sanchez-Cortes
11:00-11:10 Lucie Habartova 11:00-11:10 Short break
11:10-11:20 Pavel Michal 11:10-11:20 Elena Possenti
11:20-11:30 Grzegorz Zając 11:20-11:30 Lisa Vaccari
11:30-11:50 Discussion (live) 11:30-11:50 Discussion (live)
11:50-12:00 Break
MAIN ROOM
12:00-13:00 Webinar 2 of the Platinum Sponsor – BioTools
13:00-13:30 Lunch Time (30 min)
13:30-14:50 PARALLEL SESSIONS 6 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
1.10. Chemometrics, Artificial 2.6. Forensic and Security Sciences 2.1. Analytical Techniques in Industry
Intelligence and Machine Learning Chair: Maxim Darvin Chair: Karen Esmonde-White
Chair: Ewelina Matuszyk
13:30-13:45 Claudia Beleites 13:30-13:45 Agnieszka Banas 13:30-13:45 Alison Nordon
13:45-14:00 Alex Henderson 13:45-14:00 Grzegorz Zadora 13:45-14:00 Gerwin Puppels
14:00-14:10 Nicolas Goffin 14:00-14:10 František Králík 14:00-14:10 Amuthachelvi Daniel
14:10-14:20 Christel Kamp 14:10-14:20 Piyush Kumar 14:10-14:20 Yuta Hikima
14:20-14:30 M. Hamed Mozaffari 14:20-14:30 Anna Wójtowicz 14:20-14:30 Christian Huck
14:30-14:50 Discussion (live) 14:30-14:50 Discussion (live) 14:30-14:50 Discussion (live)
14:50-15:00 Break
MAIN ROOM
15:00-16:30 Plenary session (1h 30 min)
Chair: Georg Ramer, Cynthia McMurray
15:05-15:35 Ji-Xin Cheng
15:40-16:10 Kathleen M. Gough
16:10-16.15 Advertisement of Platinum and Gold Sponsors
16:15-16:30 Discussion (live)
16:30-17:30 Webinar 3 of the Platinum Sponsor – EKSPLA
16Wednesday, 25th August 2021
MAIN ROOM
8:45-9:00 Advertisement of Platinium and Gold Sponsors
09:00-10:20 PARALLEL SESSIONS 7 (1h 20 min)
GREEN ROOM YELLOW ROOM
2.4. Life and Environmental Sciences 1.9. Computational Spectroscopy/ Quantum Approach
Chair: Katarzyna Cieślik-Boczula Chair: Krzysztof Bec
09:00-09:15 Giovanni Birarda 09:00-09:15 Malgorzata Biczysko
09:15-09:30 Hirotsugu Hiramatsu 09:15-09:30 Yukihiro Ozaki
09:30-09:40 Krzysztof Czamara 09:30-09:40 Danijela Bakarić
09:40-09:50 Judith Mihály 09:40-09:50 Justyna Grabska
09:50-10:00 Robert Stach 09:50-10:00 Hubert Joe
10:00-10:20 Discussion (live) 10:00-10:20 Discussion (live)
10:20-10:30 Break
10:30-11:50 PARALLEL SESSIONS 8 (1h 20 min)
GREEN ROOM YELLOW ROOM
2.2. Biomedical Applications 1.10. Chemometrics, Artificial
Chair: Lisa Vaccari Intelligence and Machine Learning
Chair: Frank Westad
10:30-10:45 Hugh Byrne 10:30-10:45 Achim Kohler
10:45-11:00 Peter Gardner 10:45-11:00 Shinsuke Shigeto
11:00-11:10 Beata Brożek-Płuska 11:00-11:10 Agnieszka Martyna
11:10-11:20 Hemanth Noothalapati 11:10-11:20 Thomas Mayerhöfer
11:20-11:30 Katarzyna Pogoda 11:20-11:30 Woosuk Sohng
11:30-11:50 Discussion (live) 11:30-11:50 Discussion (live)
11:50-12:00 Break
MAIN ROOM
12:00-13:00 Webinar 4 of the Platinum Sponsor – Bruker
13:00-13:30 Lunch Time (30 min)
13:30-14:50 PARALLEL SESSIONS 9 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
2.4. Environmental Sciences 2.8. Nanomaterials and nanostructures 1.5. Emerging Techniques
Chair: Kareem Elsayad Chair: Andrzej Kudelski Chair: Michael George
13:30-13:45 Piotr Mak 13:30-13:45 Sergey Kharintsev 13:30-13:45 Katsumasa Fujita
13:45-14:00 Belinda Pastrana-Rios 13:45-14:00 Stephanie Reich 13:45-14:00 Lyngyan Shi
14:00-14:10 Karolina Chrabąszcz 14:00-14:10 Anerise de Barros 14:00-14:10 Alicja Dąbrowska
14:10-14:20 Agnieszka Dróżdż 14:10-14:20 Susmita Bhattacharya 14:10-14:20 Gianluca Grenci
14:20-14:30 Alberto Mezzetti 14:20-14:30 Federica Piccirilli 14:20-14:30 Marcin Pastorczak
14:30-14:50 Discussion (live) 14:30-14:50 Discussion (live) 14:30-14:50 Discussion (live)
14:50-15:00 Break
MAIN ROOM
15:00-16:30 Plenary session (1h 30 min)
Chair: Judy Kim, Dario Pollio
15:05-15:35 Sylvie Roke
15:40-16:10 Eric Potma
16:10-16.15 Advertisement of Platinum and Gold Sponsors
16:15-16:30 Discussion (live)
16:30-17:30 Webinar 5 of the Platinum Sponsor- Renishaw
17Thursday, 26th August 2021
MAIN ROOM
9:00-11:05 Plenary session (2h)
Chair: Junko Morikawa, Katarzyna Marzec
09:05-9:35 Harumi Sato
09:40-10:10 Jian-Feng Li
10:15-10:45 Barbara Gil
10:45-10:50 Advertisement of Platinum and Gold sponsors
10:50-11:05 Discussion (live)
11:05-11:15 Break
11:15-12:35 PARALLEL SESSIONS 10 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
2.7. Material Science and Catalysis 1.11. Photothermal imaging 1.6. Multimodal spectroscopic imaging
Chair: Poonam Tandon Chair: Tilman Kottke Chair: Beata Brożek-Płuska
11:15-11:30 Yukio Furukawa 11:15-11:30 Oxana Klementieva 11:15-11:30 Jürgen Popp
11:30-11:45 Joanna Hetmanczyk 11:30-11:45 Francesco Simone Ruggeri 11:30-11:45 Nicholas Smith
11:45-11:55 Maciej Bik 11:45-11:55 Mustafa Kansiz 11:45-11:55 Harald Fitzek
11:55-12:05 Yusuke Morisawa 11:55-12:05 Natalia Piergies 11:55-12:05 Tchaya Njantio Maxime
12:05-12:15 Nobutaka Shioya 12:05-12:15 Miriam Unger 12:05-12:15 Artur Surówka
12:15-12:35 Discussion (live) 12:15-12:35 Discussion (live) 12:15-12:35 Discussion (live)
12:35-13:00 Lunch Time (25 min)
MAIN ROOM
13:00-14:00 Webinar 6 of the Platinum Sponsor – Toptica Photonics AG
14:00-14:10 Break
14:10-15:30 PARALLEL SESSIONS 11 (1h 20 min)
GREEN ROOM YELLOW ROOM RED ROOM
2.7. Material Science and Catalysis 2.2. Biomedical Applications 1.12. Brillouin spectroscopy
Chair: Anatoli Ianoul Chair: Monica Marro Chair: Marta Pacia
14:10-14:25 Andrzej Kolezynski 14:10-14:25 Ishan Barman 14:10-14:25 Kristie Koski
14:25-14:40 Elena Solovyeva 14:25-14:40 Pascaline Bouzy 14:25-14:40 Francesca Palombo
14:40-14:50 Zhangfei Su 14:40-14:50 Katherine Ember 14:40-14:50 Martina Alunni Cardinali
14:50-15:00 István Székely 14:50-15:00 Ota Samek 14:50-15:00 Timon Beck
15:00-15:10 Laszlo Ujj 15:00-15:10 Kamila Sofińska 15:00-15:10 Kareem Elsayad
15:10-15:30 Discussion (live) 15:10-15:30 Discussion (live) 15:10-15:30 Discussion (live)
15:30-15:40 Break
MAIN ROOM
15:45-17:05 Perspective Lectures (1h 45 min)
Chair: Sergei Kazarian, Małgorzata Barańska
15:50-16:10 Hiro-o Hamaguchi
16:15-16:35 Isao Noda
16:40-17:00 Peter Griffiths
17:05-17:25 V. Ara Apkarian
17:25-17:45 Discussion (live)
17:45-18:00 Closing Ceremony
18Detailed programme
Monday, 23rd August 2021
08:45 Opening Ceremony
9:00-11:45 Plenary session
Chair: Nick Stone
09:05-9:35 Watching dynamics of single bonds
Jeremy Baumberg1
1
NanoPhotonics Centre, Cavendish Laboratory, University of Cambridge, UK
09:40-10:10 Challenges in the application of one and two-photon excited SERS to bioorganic samples
Janina Kneipp1
1
Humboldt-Universität zu Berlin, Germany
10:15-10:45 Spectroscopy goes Viral
Bayden R. Wood1
Kamila Kochan1, Diana E. Bedolla1, Supti Roy1, Dale I. Godfrey2, Damian F. J. Purcell, Philip Heaud
1
Centre for Biospectroscopy, Monash University, Victoria, Australia
2
Department of Microbiology and the Biomedicine Discovery Institute, Faculty of Medicine, Nursing and Health
Sciences, Monash University, Victoria, Australia
10:45- 10:50 Advertisement of Platinum and Gold Sponsors
10:50-11:05 Discussion (live)
11:05-11:15 Break
11:15-12:30 PARALLEL SESSIONS 1
1.1 Plasmonics
Chair: Yaakow Tischler
11:15-11:30 Charge Transfer Effect For SERS
Young Mee Jung1
1
Kangwon National University, Korea
11:30-11:45 Tip-enhanced Raman spectroscopy for studying 2D materials
Bin Ren1
Sisi Wu, Yi-Fan Bao, Maofeng Cao, Tengxiang Huang, Xiang Wang
1
Xiamen University, China
11:45-11:55 Excitation conditions for surface-enhanced hyper Raman scattering with gold nanospheres
and nanorods
Arpad Dusa1
Fani Madzharova1, Janina Kneipp1
1
Department of Chemistry, Humboldt-Universität zu Berlin, Germany
11:55-12:05 Super-resolution Surface-Enhanced Raman Scattering microscopy via polarization contrast
Oleksii Ilchenko1
Denys Slobodianiuk2, Yuriy Pilgun2, Andrii Kutsyk2, Kaiyu Wu3, Lasse Højlund Eklund Thamdrup1, Anja Boisen1
1
Technical University of Denmark
2
Taras Shevchenko National University of Kyiv
3
Shanghai Jiao Tong University
12:05-12:15 Galvanic vs. electrochemical fabrication of the plasmonic layer: SERS study of yellow natural
compounds
Marie Svecova1
1
University of Chemistry and Technology, Czech Republic
12:15-12:35 Discussion (live)
191.7. Instrumental Development
Chair: Wojciech Kwiatek
11:15-11:30 Very High Pressure Studies With Infrared Sources: For Static To Dynamic Approaches
Paul Dumas1
1
SOLEIL Synchrotron, France
11:30-11:45 Normal-to-Cancer Transition in Human Cells – Insights from Quasi-elastic Neutron Scattering
Maria Paula Marques1
1
University of Coimbra, Portugal
11:45-11:55 An ultra-low cost, synchronisation free, versatile light source for targeted CARS multiphoton imaging
Konstantinos Bourdakos1
Duanyang Xu2, Peter Johnson1, Anna Crisford1, Lin Xu2, Sijing Liang2, Jonathan Price2, David Richardson2,
Sumeet Mahajan1
1
Institute for Life Sciences and School of Chemistry, University of Southampton, UK
2
Optoelectronics Research Centre, University of Southampton, UK
11:55-12:05 Current state and future of the IRIS THz/Infrared beamline at BESSY II
Alexander Veber1
Ljiljana Puskar2, Victor M. R. Zancajo3, Janina Kniepp3, Ulrich Schade2
1
Chemistry Department, Humboldt-Universität zu Berlin, Germany
2
Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Berlin, Germany
3
School of Analytical Sciences Adlershof (SALSA) and Chemistry Department, Humboldt-Universität zu Berlin, Germany
12:05-12:15 Solaris Advanced InfraRed (SOLAIR) beamline conceptual design
Tomasz Wróbel1
Danuta Liberda1, Paulina Kozioł1, Adriana Wawrzyniak1, Andrzej Marendziak1, Paweł Nowak1, Marcin Zając1,
Kamilla Malek2, Wojciech Kwiatek3, Paul Dumas4, Marek Stankiewicz5
1
Solaris National Synchrotron Radiation Centre, Jagiellonian University, Krakow, Poland
2
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
3
Institute of Nuclear Physics Polish Academy of Sciences, Krakow, Poland
4
SMIS beamline, SOLEIL synchrotron, L’orme des Merisiers, Gif sur Yvette, France
5
Jagiellonian University
12:15-12:35 Discussion (live)
2.2 Biomedical Applications
Chair: Alison Hobro
11:15-11:30 Highlighting the clinical utility of a novel spectroscopic liquid biopsy for triage of patients with
suspected brain cancer
Matthew J. Baker1
James M. Cameron1, Paul M. Brennan2, Georgios Antoniou1, Holly J. Butler1, Loren Christie1, Justin J.A. Conn1,
Mark G. Hegarty1, Alexandra Sala1, David Palmer1, Benjamin R. Smith1, Ewan Gray3, Michael D. Jenkinson4,
Catriona Keerie5, John Norrie5, Rachel O’Brien6
1
Dxcover Ltd. ClinSpec Diagnostics Ltd.
2
Translational Neurosurgery, Centre for Clinical Brain Sciences, University of Edinburgh, UK
3
Independent Health Economics Consultant, Edinburgh, UK
4
Institute of Translational Medicine, University of Liverpool & The Walton Centre NHS Foundation Trust,
Lower Lane, Liverpool, UK
5
Edinburgh Clinical Trials Unit, Usher Institute – University of Edinburgh, Edinburgh Bioquarter, UK
6
Emergency Medicine Research Group (EMERGE), Royal Infirmary of Edinburgh, UK
11:30-11:45 Raman spectroscopy for early detection of cervical pre-cancer using minimally invasive exfoliated
cell samples
Fiona Lyng1
Damien Traynor1,2, Alison Malkin3, Franck Bonnier4, Cara M. Martin5,6,7, John J. O’Leary5,6,7
1
Centre for Radiation and Environmental Science, FOCAS Research Institute, Technological University Dublin,
City Campus, Dublin, Ireland
2
School of Physics & Clinical & Optometric Sciences, Technological University Dublin, City Campus, Dublin, Ireland
3
School of Biological and Health Sciences, Technological University Dublin, City Campus, Dublin, Ireland
4
EA 6295 Nanomédicaments et Nanosondes, Université de Tours, Tours, France.
5
Discipline of Histopathology, University of Dublin Trinity College, Dublin, Ireland
6
Emer Casey Molecular Pathology Research Laboratory, The Coombe Women and Infants University Hospital,
Dublin, Ireland
7
CERVIVA Research Consortium, Dublin, Ireland
2011:45-11:55 Can The Diagnostics Of Colorectal Polyps Benefit From Using In Vivo Raman Spectroscopy?
Markéta Fousková1
Magdaléna Nahodilová1, Lucie Habartová1, Alla Sinica1, Michaela Miškovičová2, Jaromír Petrtýl2,
Luboš Petruželka2, Vladimír Setnička1
1
Department of Analytical Chemistry, University of Chemistry and Technology, Prague, Czech Republic
2
Department of Oncology, Charles University and General University Hospital in Prague, Czech Republic
11:55-12:05 Characterization of cariogenic streptococci-derived biofilms using FT-IR and Raman spectroscopic
imaging
Mikołaj Krysa1
Barbara Gieroba1, Adrian Wiater2, Anna Sroka-Bartnicka1,2
1
Medical University of Lublin, Department of Biopharmacy
2
Maria Curie-Skłodowska University, Department of Industrial and Environmental Microbiology
12:05-12:15 Accurate and highly stable indicators of protein synthesis through sparse classification
Nicolas Pavillon1
Nicholas I. Smith1
1
Osaka University
12:15-12:35 Discussion (live)
12:35-13:00 Lunch Time (25 min)
13:00-14:00 Webinar 1 of the Platinum Sponsor – Teledyne Princeton Instruments
14:00-14:10 Break
14:10-15:30 PARALLEL SESSIONS 2
1.4. Time-Resolved Spectroscopy
Chair: Siva Umapathy
14:10-14:25 An isolated water droplet in the aqueous solution of a supramolecular tetrahedral cage
as observed by thz spectroscopy
Martina Havenith1
1
Department of Physical Chemistry II Ruhr-Universität Bochum, Germany
14:25-14:40 Time-domain Stimulated Resonance Raman goes 2D
Tullio Scopigno1
1
Sapienza University of Rome and Center for Life-Nano Science, Italy
14:40-14:50 Microsecond Resolved Infrared Spectroelectrochemistry using Dual Frequency Comb IR Lasers
Ian Burgess1
1
University of Saskatchewan
14:50-15:00 Using Time-resolved Vibrational Spectroscopy for Manufacturing with Light: From Picoseconds to Tonnes
Michael George1
1
University of Nottingham, UK
15:00-15:10 Non-repetitive protein dynamics on microsecond to second time-scales monitored by mid-infrared
dual comb spectroscopy (DCS)
Markus Mangold1
Florian Eigenmann1, Raphael Horvath1, Carsten Kötting2, Klaus Gerwert2
1
IRsweep AG
2
Ruhr Universität Bochum
15:10-15:30 Discussion (live)
1.8. Sensing
Chair: Jaebum Choo
14:10-14:25 Metal nanostructures for surface enhanced vibrational spectroscopy: from spheres to anisotropic
nanoparticles
Angela Lopez-Lorente1
1
University of Cordoba, Spain
14:25-14:40 Quantum dots for surface-enhanced infrared spectroscopy: an multivariate approach
Claudete Fernandes Pereira1
J.J. Silva1, I.G. Souza Sobrinha1, G.A.L. Pereira1, B.S. Santos2, B. Krebs3, B. Mizaikoff3
1
Department of Fundamental Chemistry, Federal University of Pernambuco, Brazil
2
Department of Pharmaceutical Sciences, Federal University of Pernambuco, Recife, Brazil
3
Institute of Analytical and Bioanalytical Chemistry, Ulm University, Ulm, Germany
2114:40-14:50 Searching for the chemically stable reporter for SERS-based pH nanosensor – from rhodanine to
5-(4-dimethylaminobenzylidene)rhodanine to avoid plasmon-induced dimerization
Agata Królikowska1
Jan Krajczewski1, Marcin Wiktowski1
1
University of Warsaw, Faculty of Chemistry, Poland
14:50-15:00 SERS switch on/off mediated by adions
Nicolae Leopold1
Stefania D. Iancu1, Andrei Stefancu1
1
Faculty of Physics, Babeş-Bolyai University, Cluj-Napoca, Romania
15:00-15:10 SERS immunoassays for detection of inflammation factors in biosamples
Ewelina Wiercigroch1
Paweł Swit1, Elzbieta Stepula2, Katarzyna Kaminska1, Agnieszka Brzoska1, Sebastian Schlucker2, Kamilla Malek1
1
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
2
Department of Chemistry, University of Duisburg-Essen, Germany
15:10-15:30 Discussion (live)
2.4. Life and Environmental Sciences
Chair: Airton Abrahao Martin
14:10-14:25 Metabolic Raman Imaging in Cancer Research
Halina Abramczyk1
Monika Kopiec1, Beata Brożek-Płuska1, Jakub Surmacki1, Maciej Radek2
1
Lodz University of Technology, Institute of Applied Radiation Chemistry, Laboratory of Laser Molecular
Spectroscopy, Lodz, Poland
2
Medical University of Lodz, Department of Neurosurgery, Spine and Peripheral Nerve Surgery, University Hospital
WAM-CSW, Poland
14:25-14:40 FTIR for quantitative analysis of bioactive substances in food products
Adriana S. Franca1
Laís M. Resende
1
Universidade Federal de Minas Gerais, Brazil
14:40-14:50 Rac1 regulates biochemical, nanomechanical and nanostructural aspects of TNF-α-induced
inflammatory response in vascular endothelium in aorta
Marta Pacia1
Natalia Chorazy1, Magdalena Sternak1, Benedikt Fels2, Kristina Kusche-Vihrog2, Michal Pacia3,
Mariusz Kepczynski3, Stefan Chlopicki1
1
Jagiellonian Centre for Experimental Therapeutics (JCET), Jagiellonian University, Krakow, Poland
2
Institute of Physiology, University of Lubeck, Germany
3
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
14:50-15:00 Quantum cascade laser-based IR spectroscopy for highly sensitive analysis of proteins
Andreas Schwaighofer1
Christopher Karim Akhgar1, Bernhard Lendl1
1
TU Vienna
15:00-15:10 ATR-FTIR and Raman spectroscopic imaging in evaluation of stem cells-induced bone formation
on the hydroxyapatite-based scaffold
Anna Sroka-Bartnicka1
Barbara Gieroba1, Agata Przekora2, Grzegorz Kalisz2, Paulina Kazimierczak2, Cai Li Song3, Sergei G. Kazarian3,
Michal Wojcik2
1
Department of Biopharmacy, Medical University of Lublin, Poland
2
Department of Biochemistry and Biotechnology, Medical University of Lublin, Poland
3
Department of Chemical Engineering, Imperial College London, UK
15:10-15:30 Discussion (live)
15:35-15:45 Break
15:45-17:05 PARALLEL SESSIONS 3
Parallel session 7-1.1 Plasmonics
Chair: Alexandre Brolo
15:45-16:00 Geometric and electronic redox properties of single-molecule junctions probed with EC-TERS
and plasmon-supported break-junction experiments
Katrin Domke1
1
MPI Polymer Research, Germany
2216:00-16:15 Fractal Metastructures for Infrared Plasmonics
Francois Lagugné-Labarthet1
1
Western University, Chemistry Department, Canada
16:15-16:25 Mid-infrared lab-on-a-chip for highly-sensitive plasmonic sensing of proteins
Broislav Hinkov1
Florian Pilat1, Laurin Lux2, Patrícia Lustoza Souza1, Andreas Schwaighofer2, Benedikt Schwarz1,
Hermann Detz1, Aaron M. Andrews1, Bernhard Lendl2, Gottfried Strasser1
1
Institute of Solid State Electronics and Center for Micro- and Nanostructures, TU Wien, Austria
2
Institute of Chemical Technologies and Analytics, TU Wien, Austria
16:25-16:35 Metasurface-Enhanced IR Spectroscopy Augmented by Artificial Intelligence for Resolving Dynamics
between Major Biomolecules
Aurelian John-Herpin1
Hatice Altug1
1
Ecole Polytechnique Federale de Lausanne (EPFL)
16:35-16:45 Au@Fe3O4 nanoparticles as plasmonic-magnetic nanomaterial for Raman analysis of surfaces
Andrzej Kudelski1
1
University of Warsaw, Poland
16:45-17:05 Discussion (live)
1.2. Non-Linear Vibrational Spectroscopy
Chair: Dennis Hore
15:45-16:00 Fourier-domain stimulated Raman scattering tomography enables label-free volumetric deep tissue
imaging with subcellular resolution
Zhiwei Huang1
Li Gong, Shulang Lin,
1
National University of Singapore, Singapore
16:00-16:15 Multicolor imaging with stimulated Raman scattering
Yasuyuki Ozeki1
1
University of Tokyo, Japan
16:15-16:25 Effects Of Elevated Temperatures On The Silica Surface Charge Revealed by Interfacial Water SFG Signal
Md Shafiul Azam1
Canyu Cai1, Julianne Gibbs2, Eric Tyrode3, Dennis Hore1
1
University of Victoria, Victoria, Canada
2
University of Alberta, Edmonton AB, Canada
3
KTH Royal Institute of Technology, Stockholm, Sweden
16:25-16:35 Broadb And Impulsive Stimulated Raman Scattering Based On A Chirped Detection
Giovanni Batiganani1
1
”Sapienza” University of Rome, Italy
16:35-16:45 Studying The Sensing Activities Of Organic Nanoparticles And Their Interfacial Structure
At Air/Aqueous Interface Using Nonlinear Vibrational Spectroscopy
Harpreet Kaur1
Gaganpreet Kaur2, Navneet Kaur3, Narinder Singh3, Kailash Chandra Jena1
1
Department of Physics, Indian Institute of Technology Ropar, Punjab, India
2
Centre for Nanoscience & Nanotechnology, Panjab University, Chandigarh, India
3
Department of Chemistry, Panjab University, Chandigarh, India
16:45-17:05 Discussion (live)
1.3. Near-field Vibrational Spectroscopy
Chair: Sebastian Schlücker
15:45-16:00 Tip-enhanced Raman studies of abnormal protein aggregation – advantages of measurements in liquid
Ewelina Lipiec1
Janina Kaderli2, Jan Kobierski3, Roland Riek2, Katarzyna Skirlińska-Nosek1, Kamila Sofińska1,
Marek Szymoński1, Renato Zenobi2
1
M. Smoluchowski Institute of Physics, Jagiellonian University, Krakow, Poland
2
Department of Chemistry and Applied Biosciences, ETH Zurich, Switzerland
3
Department of Pharmaceutical Biophysics, Faculty of Pharmacy, Jagiellonian University Medical College, Poland
2316:00-16:15 Vibrational exciton and polaron nano-imaging: a molecular ruler to image structure, coupling, and
disorder in functional molecular materials
Markus Raschke1
1
Department of Physics, Department of Chemistry, and JILA, University of Colorado, Boulder, USA
16:15-16:25 Probing liquid interfaces and sub-surface materials with broadband infrared nanospectroscopy
Hans Bechtel1
Jonathan Larson2, Yi-Hisen Lu3, Artem Baskin4, Xiao Zhao3, Paul Ashby4, David Prendergast4,
Stephanie Gilbert Corder1, Miquel Salmeron3, Robert Kostecki2
1
Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, USA
2
Energy Storage & Distributed Resources Division, Lawrence Berkeley National Laboratory, Berkeley, California, USA
3
Materials Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California, USA
4
Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, California, USA
16:25-16:35 Nano-FTIR applications for biomaterials and medical research
Adrian Cernescu1
Bogdan Sava1
1
attocube systems AG
16:35-16:45 Investigation of explosive nanoparticles with TERS
Tanja Deckert-Gaudig1
Volker Deckert1, Jakob Hübner2, Denis Spitzer2
1
IPHT-Leibniz Institute of Photonic Technology
2
ISL, French-German Research Institute of Saint-Louis, France
16:45-17:05 Discussion (live)
24Tuesday, 24th August 2021
8:45-9:00 Advertisment of Gold and Platinium Sponsors
09:00-10:20 PARALLEL SESSIONS 4
1.10. Chemometrics, Artificial Intelligence and Machine Learning
Chair: Christian Huck
9:00-9:15 Comparability of Raman Spectroscopic Configurations: A Large Scale Cross-Laboratory Study
Thomas Bocklitz1
1
Leibniz Institute of Photonic Technology, Germany
9:15-9:30 Assessment of Oocyte Maturation using resonance Raman Spectroscopy based on the mitochondrial
respiratory activity and lipid metabolism
Mika Ishigaki1
Shinsuke Kashiwagi2, Satoru Wakabayashi2, Yumi Hoshino3
1
Shimane University, Japan
2
HORIBA, Ltd.
3
Japan Women’s University
9:30-9:40 Application of multivariate statistics and 2D infrared correlation spectroscopy in the investigation
of drying process of propolis
Krzysztof Banas1
1
Singapore Synchrotron Light Source
9:40-9:50 Cocrystal Formation between Ibuprofen and Nicotinamide Revealed Using THz and IR Spectroscopy
with Multivariate Analysis
Sae Ishihara1
Yusuke Hattori2, Makoto Otsuka3, Tetsuo Sasaki1
1
Graduate School of Medical Photonics, Shizuoka University, Japan
2
Research Institute of Pharmaceutical Sciences, Musashino University
3
Musashino University, Research Institute of Electronics, Shizuoka University, Japan
9:50-10:00 The importance of choosing the right protocol for leukemia cell studies using Raman imaging
Anna M. Nowakowska1
Aleksandra Borek-Dorosz1, Patrycja Leszczenko1, Adriana Adamczyk1, Anna Pieczara2, Justyna Jakubowska3,
Kinga Ostrowska3, Agata Pastorczak3, Krzysztof Brzozowski3, Małgorzata Barańska1, Katarzyna M. Marzec2,
Katarzyna Majzner1
1
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
2
Jagiellonian Centre for Experimental Therapeutics (JCET), Jagiellonian University, Krakow, Poland
3
Medical University of Łodz, Poland
10:00-10:20 Discussion (live)
2.3. Drug Delivery and Monitoring
Chair: Keith Gordon
9:00-9:15 Combining Pharmacokinetics and Vibrational Spectroscopy: MCR-ALS Hard soft modelling of drug
uptake in vitro using tailored kinetic constraints
David Pérez Guaita1
Guillermo Quintás2, Romá Tauler3, Hugh J. Byrne4
1
Valencia University, Spain
2
Health and Biomedicine, Leitat Technological Centre, Barcelona, Spain
3
IDAEA-CSIC, Barcelona, Spain
4
FOCAS Research Institute, Technological University Dublin, Ireland
9:15-9:30 Low frequency Raman spectroscopy for monitoring drug solubilization in milk-based formulations
during digestion
Sara J. Miller1
Malindla Salim2, Karlis Berzins1, Joshua J. Sutton1, Keith C. Gordon1, Ben J. Boyd2
1
Department of Chemistry, University of Otago, Dunedin, New Zealand
2
Drug Delivery, Disposition and Dynamics, Monash Institute of Pharmaceutical Sciences, Monash University,
Melbourne, Australia
9:30-9:40 The fate of targeted SERS probes: Will they make it to the nucleus?
Daniela Drescher1
Tina Büchner1
Heike Traub2, Stephan Werner3, Peter Guttmann3, Janina Kneipp1
1
Humboldt-Universität zu Berlin, Department of Chemistry, Germany
2
BAM Federal Institute for Materials Research and Testing, Germany
3
Helmholtz-Zentrum Berlin für Materialien und Energie, BESSY II, Germany
259:40-9:50 How Ionophore-Valinomycin Enters and Transports K+ Across a Model Bilayer Lipid Membrane
Jacek Lipkowski1
Zhangfei Su1
1
Department of Chemistry, University of Guelph
9:50-10:00 Towards Raman spectroscopy- based high-content profiling of endothelial cytotoxicity
Katarzyna Majzner1
Ewelina Bik1, Jagoda Orleańska1, Małgorzata Barańska1, Stefan Chłopicki2, Katarzyna Majzner1
1
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
2
Jagiellonian Centre for Experimental Therapeutics (JCET), Jagiellonian University, Krakow, Poland
10:00-10:20 Discussion (live)
1.8. Sensing
Chair: Maciej Roman
9:00-9:15 Empowering Surface-Enhanced IR Spectroscopy with Broadband Metasurfaces and Artificial Intelligence
Hatice Altug1
1
EPFL Lausanne, Switzerland
9:15-9:30 Mid-Infrared Arthroscopy: The Road to Real-Time In Vivo Cartilage Condition Assessment
Boris Mizaikoff1
1
Institute of Analytical and Bioanalytical Chemistry & Hahn-Schickard, Institute for Microanalysis Systems, Ulm
University, Germany
9:30-9:40 Occlusion induced bonding state of water molecules decrease in the uppermost stratum corneum
determined by in vivo confocal Raman microspectroscopy
Maxim Darvin1
Johannes Schleusener1, Sehyok Choe2, Jinsong Ri2, Jürgen Lademann1, Chunsik Choe2
1
Charité-Universitätsmedizin Berlin, Department of Dermatology, Venerology and Allergology, Germany
2
Kim Il Sung University, Taesong District, Ryongnam, DPR Korea
9:40-9:50 Detection of the molecular alterations of hemoglobin structures inside living red blood cells
and isolated proteins
Jakub Dybas1
Tapiwa Chiura2, Katarzyna M. Marzec1, Piotr J. Mak2
1
Jagiellonian University, Jagiellonian Centre for Experimental Therapeutics (JCET), Krakow, Poland
2
Saint Louis University, Chemistry Department, Missouri, USA
9:50-10:00 Multispectral fiber sensing for biomedical applications
Iskander Usenov1
Tatiana Sakharova2, Andrey Bogomolov3, Alexey Bocharnikov2, Viacheslav Artyushenko2
1
Technische Universität Berlin, Germany
2
art photonics GmbH, Berlin, Germany
3
Samara State Technical University, Samara, Russia
10:00-10:20 Discussion (live)
10:20-10:30 Break
10:30-11:50 PARALLEL SESSIONS 5
1.13 Chiroptical spectroscopy
Chair: Monika Hałat
10:30-10:45 Interplay of the ECD and RROA induced chirality: towards understanding the solvent and substituent
effects on naphthalene diimide spectra
Joanna Rode1
Ewa Machalska2, Dorota Kaczorek4, Robert Kawęcki4, Grzegorz Ząjac3, Małgorzata Barańska2,3, Krzysztof
Lyczko1, Jan Dobrowolski1
1
Institute of Nuclear Chemistry and Technology, Warsaw, Poland
2
Faculty of Chemistry, Jagiellonian University, Krakow, Poland
3
Jagiellonian Centre for Experimental Therapeutics, Jagiellonian University, Krakow, Poland
4
Siedlce University, Faculty of Science, Poland
10:45-11:00 “Watching” a Molecular Twist in a Protein by Raman Optical Activity
Masashi Unno1
Takashi Kikukawa2, Tomotsumi Fujisawa2, Wouter D. Hoff3
1
Saga University, Japan
2
Hokkaido University, Japan
3
Oklahoma State University, USA
2611:00-11:10 From cirrhosis to cancer – A spectroscopic study
Lucie Habartova1
Katerina Hrubesova1, Ondrej Vrtelka1, Petr Hribek2, Kristyna Kubickova2, Petr Urbanek2, Vladimir Setnicka1
1
Dept. of Analytical Chemistry, UCT Prague, Czech Republic
2
First Faculty of Medicine, Charles University and Military University Hospital Prague, Czech Republic
11:10-11:20 Raman optical activity in extended spectral range
Pavel Michal1
Josef Kapitán1, Petr Bouř2
1
Department of Optics, Palacký University Olomouc, Czech Republic
2
Institute of Organic Chemistry and Biochemistry, Academy of Sciences, Prague, Czech Republic
11:20-11:30 True and false resonance Raman optical activity: a case of Vitamin B12 derivatives
Grzegorz Zając1,2
Ewa Machalska1, Aleksandra J. Wierzba6, Josef Kapitán3, Tadeusz Andruniów4, Maciej Spiegel5, Dorota Gryko6,
Petr Bouř2, Małgorzata Barańska1
1
Jagiellonian Centre for Experimental Therapeutics, Jagiellonian University, Krakow, Poland
2
Institute of Organic Chemistry and Biochemistry, Academy of Sciences, Czech Republic
3
Department of Optics, Palacký University Olomouc, Czech Republic
4
Department of Chemistry, Wroclaw University of Science and Technology, Poland
5
Department of Pharmacognosy and Herbal Medicine, Wroclaw Medical University, Poland
6
Institute of Organic Chemistry, Polish Academy of Sciences, Warsaw, Poland
11:30-11:50 Discussion (live)
2.5. Archeology and Cultural Heritage
Chair: Francesca Rosi
10:30-10:45 Sub-Surface Molecular Investigation of Cultural Heritage materials with advanced Raman
spectroscopy methods
Claudia Conti1
1
National Research Council (CNR) - Institute of Heritage Science (ISPC), Milan, Italy
10:45-11:00 Raman and Surface-Enhanced Raman Scattering Analysis of Molecular Compounds with interest for
the Cultural Heritage
Santiago Sanchez-Cortes1
1
Instituto de Estructura de la Materia, Madrid, Spain
11:00-11:10 Short break
11:10-11:20 Micro ATR-FTIR spectroscopic imaging: a technique to discover the conservation history hidden in
the stratigraphies painted on terracotta statues
Elena Possenti1
Chiara Colombo1, Marco Realini1, Cai Li Song2, Sergei G. Kazarian2
1
Istituto di Scienze del Patrimonio Culturale, Consiglio Nazionale delle Ricerche, Milan, Italy
2
Department of Chemical Engineering, Imperial College London, South Kensington Campus, UK
11:20-11:30 Cultural Heritage at SISSI-Bio: from paleo-archeology to musical instruments
Lisa Vaccari1
Giovanni Birarda1, Chiaramaria Stani2
1
Elettra Sincrotrone Trieste
2
CERCI-ERIC
11:30:11:50 Discussion (live)
11:50-12:00 Break
12:00-13:00 Webinar 2 of the Platinum Sponsor – BioTools
13:00-13:30 Lunch Time
13:30-14:50 PARALLEL SESSIONS 6
1.10. Chemometrics, Artificial Intelligence and Machine Learning
Chair: Ewelina Matuszyk
13:30-13:45 Experimental Designs for Spectroscopic Calibration: Measuring Uncertainty from Various Sources
Claudia Beleites1
1
Chemometrix GmbH, Germany
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