Dissemination

Dissemination

Title Authors Partner Source Link
Photo-Active Biological Molecular Materials: From Photoinduced Dynamics to Transient Electronic Spectroscopies Irene Conti, Matteo Bonfanti, Artur Nenov, Ivan Rivalta, Marco Garavelli UNIBO QM/MM studies of light-responsive bilogical systems View
Spectral Tuning and Photoisomerization Efficiency in Push–Pull Azobenzenes: Designing Principles Irene Conti, Giulio Cerullo, Artur Nenov, Marco Garavelli UNIBO The Journal of the American Chemical Society View
Ultrafast Spectroscopy of Photoactive Molecular Systems from First Principles: Where We Stand Today and Where We Are Going Irene Conti, Giulio Cerullo, Artur Nenov, Marco Garavelli UNIBO Journal of the American Chemical Society View
Modelling investigation of the thermal treatment of ash-contaminated particulate filters Chung Ting Lao, Jethro Akroyd, Alastair Smith, Neal M. Morgan, Kok Foong Lee, Daniel Nurkowski, Markus Kraft CMCL Pre-print publication View
Multidimensional Potential Energy Surfaces Resolved at the RASPT2 Level for Accurate Photoinduced Isomerization Dynamics of Azobenzene Flavia Aleotti, Lorenzo Soprani, Artur Nenov, Roberto Berardi, Alberto Arcioni, Claudio Zannoni, Marco Garavelli UNIBO Journal of Chemical Theory and Computation View
An ontology-enabled approach for modelling carbon black formation processes Daniel Nurkowski, Jethro Akroyd, Emanuele Ghedini, Joana Francisco Morgado, Adham Hashibon, Amit Bhave CMCL, UNIBO, FRAUNHOFER M05 session of the MSE 2020 Congress 2020
Effect of mixing on the reactive crystallization of NixMnyCo1-x-y(OH)2 hydroxides for battery applications Maria Laura Para, Mojtaba Alidoost, Mohsen Shiea, Gianluca Boccardo, Antonio Buffo, Antonello Barresi, Daniele Marchisio POLITO ISMIP10
Effect of mixing and other operating conditions on the coprecipitation of Ni0.8Mn0.1Co0.1(OH)2 as precursor for lithium-ion cathodes Daniele Marchisio, Antonio Buffo, Gianluca Boccardo, Mojtaba Alidoost, Mohsen Shiea, Maria Laura Para, Tronci Giovanni POLITO Chemical Engineering Science, Elsevier
Coprecipitation of NixMnyCoz(OH)2 as precursor for ion lithium batteries: influence of mixing and operating conditions Daniele Marchisio, Roberto Pisano, Antonello Barresi, Antonio Buffo, Gianluca Boccardo, Mojtaba Alidoost, Mohsen Shiea, Maria Laura Para POLITO 21st International Symposium on Industrial Crystallization
Development of a Modelling Framework for the Co-Precipitation of NMC Hydroxide as Precursor for Lithium Battery Cathodes Mohsen Shiea, Maria Laura Para, Antonio Buffo, Gianluca Boccardo, Daniele Marchisio POLITO 21st International Symposium on Industrial Crystallization
Computational fluid dynamics for multiscale modelling: VIMMP and SimDOME test cases Daniele Marchisio POLITO
Digitalization of Knowledge and Industrial Technologies – Towards Horizon Europe Adham Hashibon FRAUNHOFER