Wanda Andreoni - Publications, H-index & Citations

The response of single-walled carbon nanotubes to NO2 and the search for a long-living adsorbed species

IF3.6

2017-03-20

OAAI

Spina, Massimo; Karimi, Ayat; Andreoni, Wanda; Pignedoli, Carlo A.; Nafradi, Balint; Forro, Laszlo; Horvath, Endre

Atom Vacancies on a Carbon Nanotube: To What Extent Can We Simulate their Effects?

IF3.6

2016-01-21

OAAI

Kroes, Jaap M. H.; Pietrucci, Fabio; Chikkadi, Kiran; Roman, Cosmin; Hierold, Christofer; Andreoni, Wanda

Capture and Release of CO2 in Monoethanolamine Aqueous Solutions: New Insights from First-Principles Reaction Dynamics

IF5.5

2015-06-09

PREAI

Kroes, Jaap M. H.; Pietrucci, Fabio; van Duin, Adri C. T.; Andreoni, Wanda

Characterizing and Understanding Divalent Adsorbates on Carbon Nanotubes with Ab Initio and Classical Approaches: Size, Chirality, and Coverage Effects

IF5.5

2015-06-03

PREAI

Ma, Changru; Pietrucci, Fabio; Andreoni, Wanda

Fate of a Graphene Flake: A New Route toward Fullerenes Disclosed with Ab Initio Simulations

IF5.5

2014-09-17

PREAI

Kroes, Jaap M. H.; Pietrucci, Fabio; Curioni, Alessandro; Andreoni, Wanda

Atomic Oxygen Chemisorption on Carbon Nanotubes Revisited with Theory and Experiment

IF5.5

2014-02-18

PREAI

Pietrucci, Fabio; Andreoni, Wanda

The Fate of a Zwitterion in Water from ab Initio Molecular Dynamics: Monoethanolamine (MEA)-CO2

IF3.2

2013-01-15

PREAI

Kroes, Jaap M. H.; Pietrucci, Fabio; Curioni, Alessandro; Jaafar, Rached; Groening, Oliver; Andreoni, Wanda

Bridging Static and Dynamical Descriptions of Chemical Reactions: An ab Initio Study of CO2 Interacting with Water Molecules

IF5.5

2012-12-26

PREAI

Guido, Ciro A.; Pietrucci, Fabio; Gallet, Gregoire A.; Andreoni, Wanda

Data mining for materials: Computational experiments with AB compounds

IF5.5

2012-09-07

PREAI

Gallet, Gregoire A.; Pietrucci, Fabio; Andreoni, Wanda

PHYSICAL REVIEW B

IF3.7

2012-03-06

OAAI

Saad, Yousef; Gao, Da; Thanh Ngo; Bobbitt, Scotty; Chelikowsky, James R.; Andreoni, Wanda

Exohedral Hydrogen Chemisorption on a Carbon Nanotube: The Clustering Effect

CdTe surfaces: Characterizing dynamical processes with first-principles metadynamics

IF3.2

2011-12-09

PREAI

Andreoni, Wanda; Curioni, Alessandro; Kroes, Jaap M. H.; Pietrucci, Fabio; Groening, Oliver

Ta2O5 polymorphs: Structural motifs and dielectric constant from first principles Ta2O5多晶型物: 来自第一性原理的结构图案和介电常数

IF3.6

2010-10-07

PREAI

Pietrucci, Fabio; Gerra, Guido; Andreoni, Wanda

Water Adsorption at a Sodium Smectite Clay Surface: an Ab Initio Study of the First Stage

IF3.6

2010-02-09

OAAI

Andreoni, Wanda; Pignedoli, Carlo A.

Adsorption of Low-Molecular-Weight Molecules on a Dry Clay Surface: An Ab Initio Study

IF3.2

2009-08-05

PREAI

Clausen, Pascal; Andreoni, Wanda; Curioni, Alessandro; Hughes, Eric; Plummer, Christopher J. G.