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Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
September 20, 2012
Nano-ice models for the water aggregates observed on the h-BN/Rh(111) nanomesh
Yun Ding, Marcella Iannuzzi, Jürg Hutter
ACS Nano
|
November 25, 2024
Correction to "Slip Opacity and Fast Osmotic Transport of Hydrophobes at Aqueous Interfaces with Two-Dimensional Materials"
Maria Bilichenko, Marcella Iannuzzi, Gabriele Tocci
The Journal of Physical Chemistry Letters
|
October 30, 2025
First-Principles Simulations of an X-ray Absorption Probing Redox Doping Single-Molecule Magnet
Nanchen Dongfang, Federico Totti, Marcella Iannuzzi
The Journal of Chemical Physics
|
September 8, 2014
Raman spectra from ab initio molecular dynamics and its application to liquid S-methyloxirane
Sandra Luber, Marcella Iannuzzi, Jürg Hutter
The Journal of Chemical Physics
|
March 9, 2021
CO<sub>2</sub> adsorption on the pristine and reduced CeO<sub>2</sub> (111) surface: Geometries and vibrational spectra by first principles simulations
Noah Baumann, Jinggang Lan, Marcella Iannuzzi
ACS Nano
|
August 22, 2024
Slip Opacity and Fast Osmotic Transport of Hydrophobes at Aqueous Interfaces with Two-Dimensional Materials
Maria Bilichenko, Marcella Iannuzzi, Gabriele Tocci
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2014
Wetting of water on hexagonal boron nitride@Rh(111): a QM/MM model based on atomic charges derived for nano-structured substrates
Dorothea Golze, Jürg Hutter, Marcella Iannuzzi
The Journal of Chemical Physics
|
October 2, 2025
The role of confinement and surface charge on electrical and diffusio-osmotic conductivity of electrolyte solutions from ab initio methods
Maria Bilichenko, Gabriele Tocci, Marcella Iannuzzi
The Journal of Physical Chemistry. B
|
February 24, 2006
Ab initio molecular dynamics study of heterogeneous oxidation of graphite by means of gas-phase nitric acid
Antonio Rodríguez-Fortea, Marcella Iannuzzi, Michele Parrinello
Journal of Chemical Theory and Computation
|
September 10, 2021
Subsystem Density Functional Theory Augmented by a Delta Learning Approach to Achieve Kohn-Sham Accuracy
Michela Pauletti, Vladimir V Rybkin, Marcella Iannuzzi
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Search research articles
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Showing results (11-20 of 103) with videos related to
Sort By:
Page
of 11
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
September 20, 2012
Nano-ice models for the water aggregates observed on the h-BN/Rh(111) nanomesh
Yun Ding, Marcella Iannuzzi, Jürg Hutter
ACS Nano
|
November 25, 2024
Correction to "Slip Opacity and Fast Osmotic Transport of Hydrophobes at Aqueous Interfaces with Two-Dimensional Materials"
Maria Bilichenko, Marcella Iannuzzi, Gabriele Tocci
The Journal of Physical Chemistry Letters
|
October 30, 2025
First-Principles Simulations of an X-ray Absorption Probing Redox Doping Single-Molecule Magnet
Nanchen Dongfang, Federico Totti, Marcella Iannuzzi
The Journal of Chemical Physics
|
September 8, 2014
Raman spectra from ab initio molecular dynamics and its application to liquid S-methyloxirane
Sandra Luber, Marcella Iannuzzi, Jürg Hutter
The Journal of Chemical Physics
|
March 9, 2021
CO<sub>2</sub> adsorption on the pristine and reduced CeO<sub>2</sub> (111) surface: Geometries and vibrational spectra by first principles simulations
Noah Baumann, Jinggang Lan, Marcella Iannuzzi
ACS Nano
|
August 22, 2024
Slip Opacity and Fast Osmotic Transport of Hydrophobes at Aqueous Interfaces with Two-Dimensional Materials
Maria Bilichenko, Marcella Iannuzzi, Gabriele Tocci
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2014
Wetting of water on hexagonal boron nitride@Rh(111): a QM/MM model based on atomic charges derived for nano-structured substrates
Dorothea Golze, Jürg Hutter, Marcella Iannuzzi
The Journal of Chemical Physics
|
October 2, 2025
The role of confinement and surface charge on electrical and diffusio-osmotic conductivity of electrolyte solutions from ab initio methods
Maria Bilichenko, Gabriele Tocci, Marcella Iannuzzi
The Journal of Physical Chemistry. B
|
February 24, 2006
Ab initio molecular dynamics study of heterogeneous oxidation of graphite by means of gas-phase nitric acid
Antonio Rodríguez-Fortea, Marcella Iannuzzi, Michele Parrinello
Journal of Chemical Theory and Computation
|
September 10, 2021
Subsystem Density Functional Theory Augmented by a Delta Learning Approach to Achieve Kohn-Sham Accuracy
Michela Pauletti, Vladimir V Rybkin, Marcella Iannuzzi
Page
of 11