|
|
Ion pair free energy surface as a probe of ionic liquid structure
Kalil Bernardino
,
Kateryna Goloviznina
,
Margarida F. Costa Gomes
,
Agílio Pádua
,
Mauro Ribeiro
et al.
Journal articles
hal-02938701v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Sodium diffusion in ionic liquid-based electrolytes for Na-ion batteries: the effect of polarizable force fields
Arianna Massaro
,
Jocasta Avila
,
Kateryna Goloviznina
,
Ivan Rivalta
,
Claudio Gerbaldi
et al.
Journal articles
hal-02938881v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Transferable, Polarizable Force Field for Electrolytes, Protic Ionic Liquids and Deep Eutectic Solvents
Kateryna Goloviznina
,
Zheng Gong
,
Margarida F. Costa Gomes
,
Agílio Pádua
Journal articles
hal-03102805v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Polarisable Force Field for Molecular Dynamics Simulations of Ionic Liquids
Kateryna Goloviznina
,
Margarida Costa Gomes
,
Agílio Pádua
10th International Conference of Chemistry Toulouse-Kiev, ICTK10, Jun 2019, Toulouse, France.
Conference poster
hal-02166183v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
MetalWalls: Simulating electrochemical interfaces between polarizable electrolytes and metallic electrodes
Alessandro Coretti
,
Camille Bacon
,
Roxanne Berthin
,
Alessandra Serva
,
Laura Scalfi
et al.
Journal articles
hal-03843736v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Charge transfer and polarisability in ionic liquids: a case study
Frederik Philippi
,
Kateryna Goloviznina
,
Zheng Gong
,
Sascha Gehrke
,
Barbara Kirchner
et al.
Journal articles
hal-03644382v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
The CL &Pol polarizable force field for the simulation of ionic liquids and eutectic solvents
Kateryna Goloviznina
,
Zheng Gong
,
Agílio Pádua
Journal articles
hal-03365754v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Prediction Dispersion and Induction Components for Polarizable Molecular Simulations of Ionic Liquids
Kateryna Goloviznina
,
Margarida Costa Gomes
,
Agílio Pádua
8th Congress on Ionic Liquids, COIL-8, May 2019, Beijing, China.
Conference poster
hal-02136586v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Improved carbon dioxide absorption in double-charged ionic liquids
Jocasta Avila
,
Fernando Lepre
,
Kateryna Goloviznina
,
Lorenzo Guazzelli
,
Christian Silvio Silvio Pomelli
et al.
Journal articles
hal-03365783v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Ambient energy dispersion and long-term stabilisation of large graphene sheets from graphite using a surface energy matched ionic liquid†
Justin Freeman
,
Kateryna Goloviznina
,
Hua Li
,
Martin Saunders
,
Gregory Warr
et al.
Journal articles
hal-03365774v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|
|
|
Transferable, Polarizable Force Field for Ionic Liquids
Kateryna Goloviznina
,
José N. Canongia Lopes
,
Margarida Costa Gomes
,
Agílio Pádua
Journal articles
hal-02406379v1
|
Share
Gmail
Facebook
Twitter
LinkedIn
More
|