Daniel Sethio

ORCID

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 19

Top Venues

Journal of chemical information and modeling

The journal of physical chemistry. A

Journal of chemical theory and computation

Chemical communications (Cambridge, England)

Uppsala University

University of Geneva (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Uppsala University Jan 01 2020

Sweden

Post-doctoral researcher :: Department of Chemistry - BMC

Southern Methodist University Sep 15 2017 - Dec 31 2019

United States

Post-doctoral fellow :: Department of Chemistry

Education History

University of Geneva Mar 01 2013 - Jul 31 2017

Switzerland

PHD

University of Groningen Sep 01 2010 - Aug 31 2012

Netherlands

MSC :: Department of Chemistry

Institut Teknologi Bandung Aug 01 2008 - Jul 31 2009

Indonesia

MSC :: Department of Chemistry

Publications

Daniel Sethio, Emily Azzopardi, Ignacio Fdez Galván, Roland Lindh
A Story of Three Levels of Sophistication in SCF/KS-DFT Orbital Optimization Procedures. The journal of physical chemistry. A (2024)
Daniel Sethio, Emily Azzopardi, Ignacio Fdez Galván, Roland Lindh
A Story of Three Levels of Sophistication in SCF/KS-DFT Orbital Optimization Procedures. The journal of physical chemistry. A 128 (12) (2024)
Daniel Sethio, Emily Azzopardi, Ignacio Fdez Galván, Roland Lindh
A Story of Three Levels of Sophistication in SCF/KS-DFT Orbital Optimization Procedures. The journal of physical chemistry. A 128 (12) (2024)
Daniel Sethio, Emily Azzopardi, Ignacio Fdez Galván, Roland Lindh
A Story of Three Levels of Sophistication in SCF/KS-DFT Orbital Optimization Procedures. The journal of physical chemistry. A 128 (12) (2024)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling 63 (1) (2022)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling 63 (1) (2022)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling 63 (1) (2022)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling (2022)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling 63 (1) (2022)
Daniel Sethio, Vasanthanathan Poongavanam, Ruisheng Xiong, Mohit Tyagi, Duc Duy Vo, Roland Lindh, Jan Kihlberg
Simulation Reveals the Chameleonic Behavior of Macrocycles. Journal of chemical information and modeling 63 (1) (2022)
Scott Wilcox, Daniel Sethio, Jas S Ward, Antonio Frontera, Roland Lindh, Kari T Rissanen, Máté Erdélyi
Do 2-coordinate iodine(I) and silver(I) complexes form nucleophilic iodonium interactions (NIIs) in solution? Chemical communications (Cambridge, England) 58 (32) (2022)
Daniel von der Heiden, Flóra Boróka Németh, Måns Andreasson, Daniel Sethio, Imre Pápai, Máté Erdélyi
Are bis(pyridine)iodine(I) complexes applicable for asymmetric halogenation? Organic & biomolecular chemistry 19 (38) (2021)
Bono Jimmink, Daniel Sethio, Lotta Turunen, Daniel von der Heiden, Máté Erdélyi
Probing Halogen Bonds by Scalar Couplings. Journal of the American Chemical Society 143 (28) (2021)
Daniel Sethio, João B L Martins, Latévi Max Lawson Daku, Hans Hagemann, Elfi Kraka
Modified Density Functional Dispersion Correction for Inorganic Layered MFX Compounds (M = Ca, Sr, Ba, Pb and X = Cl, Br, I). The journal of physical chemistry. A 124 (8) (2020)
Daniel Sethio, Gerardo Raggi, Roland Lindh, Máté Erdélyi
Halogen Bond of Halonium Ions: Benchmarking DFT Methods for the Description of NMR Chemical Shifts. Journal of chemical theory and computation 16 (12) (2020)
Alexis Antoinette Ann Delgado, Daniel Sethio, Ipek Munar, Viktorya Aviyente, Elfi Kraka
Local vibrational mode analysis of ion-solvent and solvent-solvent interactions for hydrated Ca2+ clusters. The Journal of chemical physics 153 (22) (2020)
Manish Sharma, Daniel Sethio, Latévi Max Lawson Daku, Hans Hagemann
Theoretical Study of Halogenated B12H nX(12- n)2- (X = F, Cl, Br). The journal of physical chemistry. A 123 (9) (2019)
Yunwen Tao, Wenli Zou, Daniel Sethio, Niraj Verma, Yue Qiu, Chuan Tian, Dieter Cremer, Elfi Kraka
In Situ Measure of Intrinsic Bond Strength in Crystalline Structures: Local Vibrational Mode Theory for Periodic Systems. Journal of chemical theory and computation 15 (3) (2019)
Daniel Sethio, Vytor P Oliveira, Elfi Kraka
Quantitative Assessment of Tetrel Bonding Utilizing Vibrational Spectroscopy. Molecules (Basel, Switzerland) 23 (11) (2018)

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Publication Activity (10 Years)

Top Topics

Top Venues

Daniel Sethio