List of works - Pablo Pou

'Sub-atomic' resolution of non-contact atomic force microscope images induced by a heterogeneous tip structure: a density functional theory study.

scientific article

Atomic-Scale Variations of the Mechanical Response of 2D Materials Detected by Noncontact Atomic Force Microscopy

scientific article published in Physical Review Letters

Atomic-scale defects and electronic properties of a transferred synthesized MoS2 monolayer

scientific article published on 04 May 2018

Charge transfer for slow H atoms interacting with Al: Atomic levels and linewidths

scientific article published on 01 October 1996

Chemical identification of individual surface atoms by atomic force microscopy

scientific article

Combining nitrogen substitutional defects and oxygen intercalation to control the graphene corrugation and doping level

scholarly article in Carbon, vol. 130, April 2018

Complex patterning by vertical interchange atom manipulation using atomic force microscopy

scientific article

Describing bond-breaking processes by reactive potentials: Importance of an environment-dependent interaction range

article by Lars Pastewka et al published 7 October 2008 in Physical Review B

Exchange correlation energy as a function of the orbital occupancies: Implementation on first principles local orbital methods

Exchange–correlation energy in the orbital occupancy method: electronic structure of organic molecules

Forces and Currents in Carbon Nanostructures: Are We Imaging Atoms?

scientific article published in Physical Review Letters

Graphene Tunable Transparency to Tunneling Electrons: A Direct Tool To Measure the Local Coupling.

scientific article

Graphene monovacancies: Electronic and mechanical properties from large scale ab initio simulations

scholarly article in Carbon, vol. 103, July 2016

High-accuracy large-scale DFT calculations using localized orbitals in complex electronic systems: the case of graphene-metal interfaces

scientific article published on 23 November 2018

Hydrogen bonded trimesic acid networks on Cu(111) reveal how basic chemical properties are imprinted in HR-AFM images

scientific article published in 2021

Interplay between Switching Driven by the Tunneling Current and Atomic Force of a Bistable Four-Atom Si Quantum Dot.

scientific article

Local-orbital occupancy formulation of density functional theory: Application to Si, C, and graphene

scholarly article in Physical Review B, vol. 73 no. 23, June 2006

Molecular Identification, Bond Order Discrimination, and Apparent Intermolecular Features in Atomic Force Microscopy Studied with a Charge Density Based Method

scientific article published on 10 January 2019

Point Defects on Graphene on Metals

scientific article published in Physical Review Letters

Purely substitutional nitrogen on graphene/Pt(111) unveiled by STM and first principles calculations.

scientific article published in October 2016

Quantum degeneracy in atomic point contacts revealed by chemical force and conductance.

scientific article

Role of energy-level shifts on Auger neutralization processes: A calculation beyond the image potential

scholarly article in Physical Review B, vol. 58 no. 11, September 1998

Role of tip chemical reactivity on atom manipulation process in dynamic force microscopy.

scientific article published in August 2013

Strong dependence of flattening and decoupling of graphene on metals on the local distribution of intercalated oxygen atoms

scholarly article in Carbon, vol. 101, May 2016

Structure and stability of semiconductor tip apexes for atomic force microscopy

scientific article published on 10 June 2009

Sublattice Localized Electronic States in Atomically Resolved Graphene-Pt(111) Edge-Boundaries

scientific article published on 27 March 2014

Surface-controlled reversal of the selectivity of halogen bonds

scientific article published on 06 November 2020

The Electric Field of CO Tips and Its Relevance for Atomic Force Microscopy

scientific article

Tip-Induced Reduction of the Resonant Tunneling Current on Semiconductor Surfaces

scientific article published in Physical Review Letters

Tug-of-war between corrugation and binding energy: revealing the formation of multiple moiré patterns on a strongly interacting graphene–metal system

scientific article published on 01 July 2015

List of works by Pablo Pou

'Sub-atomic' resolution of non-contact atomic force microscope images induced by a heterogeneous tip structure: a density functional theory study.

Atomic-Scale Variations of the Mechanical Response of 2D Materials Detected by Noncontact Atomic Force Microscopy

Atomic-scale defects and electronic properties of a transferred synthesized MoS2 monolayer

Charge transfer for slow H atoms interacting with Al: Atomic levels and linewidths

Chemical identification of individual surface atoms by atomic force microscopy

Combining nitrogen substitutional defects and oxygen intercalation to control the graphene corrugation and doping level

Complex patterning by vertical interchange atom manipulation using atomic force microscopy

Describing bond-breaking processes by reactive potentials: Importance of an environment-dependent interaction range

Exchange correlation energy as a function of the orbital occupancies: Implementation on first principles local orbital methods

Exchange–correlation energy in the orbital occupancy method: electronic structure of organic molecules

Forces and Currents in Carbon Nanostructures: Are We Imaging Atoms?

Graphene Tunable Transparency to Tunneling Electrons: A Direct Tool To Measure the Local Coupling.

Graphene monovacancies: Electronic and mechanical properties from large scale ab initio simulations

High-accuracy large-scale DFT calculations using localized orbitals in complex electronic systems: the case of graphene-metal interfaces

Hydrogen bonded trimesic acid networks on Cu(111) reveal how basic chemical properties are imprinted in HR-AFM images

Interplay between Switching Driven by the Tunneling Current and Atomic Force of a Bistable Four-Atom Si Quantum Dot.

Local-orbital occupancy formulation of density functional theory: Application to Si, C, and graphene

Molecular Identification, Bond Order Discrimination, and Apparent Intermolecular Features in Atomic Force Microscopy Studied with a Charge Density Based Method

Point Defects on Graphene on Metals

Purely substitutional nitrogen on graphene/Pt(111) unveiled by STM and first principles calculations.

Quantum degeneracy in atomic point contacts revealed by chemical force and conductance.

Role of energy-level shifts on Auger neutralization processes: A calculation beyond the image potential

Role of tip chemical reactivity on atom manipulation process in dynamic force microscopy.

Strong dependence of flattening and decoupling of graphene on metals on the local distribution of intercalated oxygen atoms

Structure and stability of semiconductor tip apexes for atomic force microscopy

Sublattice Localized Electronic States in Atomically Resolved Graphene-Pt(111) Edge-Boundaries

Surface-controlled reversal of the selectivity of halogen bonds

The Electric Field of CO Tips and Its Relevance for Atomic Force Microscopy

Tip-Induced Reduction of the Resonant Tunneling Current on Semiconductor Surfaces

Tug-of-war between corrugation and binding energy: revealing the formation of multiple moiré patterns on a strongly interacting graphene–metal system