List of works - Eva G Noya

A density-functional study of the structures, binding energies and total spins of Ni–Fe clusters using nonlocal norm-conserving pseudopotentials and the generalized gradient approximation

scientific article published on 01 February 2005

A quantum propagator for path-integral simulations of rigid molecules ⬇️

scientific article published on 01 February 2011

A study of the influence of isotopic substitution on the melting point and temperature of maximum density of water by means of path integral simulations of rigid models

scientific article published on 05 October 2012

Adsorption of water, methanol, and their mixtures in slit graphite pores

scientific article published on 01 January 2019

Applicability of Quantum Thermal Baths to Complex Many-Body Systems with Various Degrees of Anharmonicity

scientific article published on 01 March 2015

Assembly of clathrates from tetrahedral patchy colloids with narrow patches

scientific article published on 01 September 2019

Assembly of trivalent particles under confinement: from an exotic solid phase to a liquid phase at low temperature

scientific article published on 01 May 2017

Can gas hydrate structures be described using classical simulations?

scientific article published on 01 March 2010

Competing ordered structures formed by particles with a regular tetrahedral patch decoration

scientific article published on 27 June 2012

Complete phase behavior of the symmetrical colloidal electrolyte

scientific article published on 01 December 2007

Computing the free energy of molecular solids by the Einstein molecule approach: Ices XIII and XIV, hard-dumbbells and a patchy model of proteins

scientific article published on 01 September 2008

Confinement of Colloids with Competing Interactions in Ordered Porous Materials

scientific article published on 03 November 2020

Determination of the melting point of hard spheres from direct coexistence simulation methods

scientific article published in April 2008

Disconnecting Symmetry Breaking from Seeded Growth for the Reproducible Synthesis of High Quality Gold Nanorods

scientific article published on 08 April 2019

Free energy calculations for molecular solids using GROMACS.

scientific article published in July 2013

Geometric structure and electronic properties of neutral and anionic Fe2C3 and Fe2C4 clusters, as obtained by density-functional calculations

scientific article published on 01 January 2004

Heat capacity of water: A signature of nuclear quantum effects

scientific article published on 01 January 2010

Local order parameters for use in driving homogeneous ice nucleation with all-atom models of water.

scientific article published in November 2012

Micelle-directed chiral seeded growth on anisotropic gold nanocrystals

scientific article published on 01 June 2020

Noncollinear magnetic order in the six-atom Mn cluster

scientific article published on 01 June 2005

Nuclear Quantum Effects in Water Clusters: The Role of the Molecular Flexibility

scientific article published on 01 February 2010

Nucleation of pseudo hard-spheres and dumbbells at moderate metastability: appearance of A15 Frank-Kasper phase at intermediate elongations

scientific article published on 01 January 2019

Nucleotide-Dependent Lateral and Longitudinal Interactions in Microtubules

scientific article published on 27 March 2013

Phase behaviour of inverse patchy colloids: effect of the model parameters

scientific article published on 26 May 2015

Phase diagram of inverse patchy colloids assembling into an equilibrium laminar phase

scientific article published on 01 November 2014

Phase diagram of model anisotropic particles with octahedral symmetry

scientific article published on 01 August 2007

Programming patchy particles to form complex periodic structures

scientific article published on 01 December 2019

Properties of ices at 0 K: A test of water models

scientific article published on 01 October 2007

Quantum contributions in the ice phases: The path to a new empirical model for water—TIP4PQ/2005

scientific article published on 01 July 2009

Quantum effects on the maximum in density of water as described by the TIP4PQ/2005 model

scientific article published on 01 September 2009

Reverse Monte Carlo modeling in confined systems

scientific article published on 01 January 2014

Reversible self-assembly of patchy particles into monodisperse icosahedral clusters

scientific article published on 01 August 2007

Revisiting the Frenkel-Ladd method to compute the free energy of solids: the Einstein molecule approach

scientific article published in October 2007

Self-Assembly of Optimally Packed Cylindrical Clusters inside Spherical Shells

scientific article published in 2022

Structural transitions in the 309-atom magic number Lennard-Jones cluster

scientific article published on 01 March 2006

Structure and water attachment rates of ice in the atmosphere: role of nitrogen

scientific article published on 29 August 2019

Surface phase transitions and crystal habits of ice in the atmosphere

scientific article published on 20 May 2020

The Young-Laplace equation for a solid-liquid interface

scientific article published on 01 November 2020

The influence of confinement on the structure of colloidal systems with competing interactions

scientific article published on 01 January 2020

The phase diagram of water at high pressures as obtained by computer simulations of the TIP4P/2005 model: the appearance of a plastic crystal phase

scientific article

The phase diagram of water from quantum simulations

scientific article published on 22 June 2012

The stability of a crystal with diamond structure for patchy particles with tetrahedral symmetry.

scientific article published on June 2010

Three-dimensional patchy lattice model for empty fluids

scientific article published on 01 December 2012

List of works by Eva G Noya