Related references
Note: Only part of the references are listed.A neural network potential-energy surface for the water dimer based on environment-dependent atomic energies and charges
Tobias Morawietz et al.
JOURNAL OF CHEMICAL PHYSICS (2012)
High-dimensional neural network potentials for metal surfaces: A prototype study for copper
Nongnuch Artrith et al.
PHYSICAL REVIEW B (2012)
Design Rules for Phase-Change Materials in Data Storage Applications
Dominic Lencer et al.
ADVANCED MATERIALS (2011)
Effect of carbon doping on the structure of amorphous GeTe phase change material
G. E. Ghezzi et al.
APPLIED PHYSICS LETTERS (2011)
Atom-centered symmetry functions for constructing high-dimensional neural network potentials
Joerg Behler
JOURNAL OF CHEMICAL PHYSICS (2011)
Nucleation mechanism for the direct graphite-to-diamond phase transition
Rustam Z. Khaliullin et al.
NATURE MATERIALS (2011)
Neural network potential-energy surfaces in chemistry: a tool for large-scale simulations
Joerg Behler
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
First-principles study of liquid and amorphous InGeTe2
E. Spreafico et al.
PHYSICAL REVIEW B (2011)
Raman spectra of cubic and amorphous Ge2Sb2Te5 from first principles
Gabriele C. Sosso et al.
PHYSICAL REVIEW B (2011)
High-dimensional neural-network potentials for multicomponent systems: Applications to zinc oxide
Nongnuch Artrith et al.
PHYSICAL REVIEW B (2011)
Signature of Tetrahedral Ge in the Raman Spectrum of Amorphous Phase-Change Materials (vol 104, 085503, 2010)
Riccardo Mazzarello et al.
PHYSICAL REVIEW LETTERS (2011)
Phase Change Materials and Their Application to Nonvolatile Memories
Simone Raoux et al.
CHEMICAL REVIEWS (2010)
Potential Energy Surfaces Fitted by Artificial Neural Networks
Chris M. Handley et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
First principles study of crystalline and amorphous Ge2Sb2Te5 and the effects of stoichiometric defects (vol 21, 255501, 2009)
S. Caravati et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2010)
Ab initio quality neural-network potential for sodium
Hagai Eshet et al.
PHYSICAL REVIEW B (2010)
Graphite-diamond phase coexistence study employing a neural-network mapping of the ab initio potential energy surface
Rustam Z. Khaliullin et al.
PHYSICAL REVIEW B (2010)
First-principles study of liquid and amorphous Sb2Te3
S. Caravati et al.
PHYSICAL REVIEW B (2010)
Signature of tetrahedral Ge in the Raman spectrum of amorphous phase-change materials
Riccardo Mazzarello et al.
PHYSICAL REVIEW LETTERS (2010)
First principles study of crystalline and amorphous Ge2Sb2Te5 and the effects of stoichiometric defects (vol 21, 255501, 2009)
S. Caravati et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2009)
First-principles study of crystalline and amorphous Ge2Sb2Te5 and the effects of stoichiometric defects
S. Caravati et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2009)
QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
Paolo Giannozzi et al.
JOURNAL OF PHYSICS-CONDENSED MATTER (2009)
A map for phase-change materials
Dominic Lencer et al.
NATURE MATERIALS (2008)
Phase-change memories
Andrea L. Lacaita et al.
PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE (2008)
Pressure-induced phase transitions in silicon studied by neural network-based metadynamics simulations
Joerg Behler et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2008)
Nonadiabatic effects in the dissociation of oxygen molecules at the Al(111) surface
Joerg Behler et al.
PHYSICAL REVIEW B (2008)
Dynamical, dielectric, and elastic properties of GeTe investigated with first-principles density functional theory
R. Shaltaf et al.
PHYSICAL REVIEW B (2008)
Fingerprints for spin-selection rules in the interaction dynamics of O2 at Al(111)
Christian Carbogno et al.
PHYSICAL REVIEW LETTERS (2008)
Metadynamics simulations of the high-pressure phases of silicon employing a high-dimensional neural network potential
Joerg Behler et al.
PHYSICAL REVIEW LETTERS (2008)
Binary alloys of Ge and Te: Order, voids, and the eutectic composition
J. Akola et al.
PHYSICAL REVIEW LETTERS (2008)
Structural phase transitions on the nanoscale:: The crucial pattern in the phase-change materials Ge2Sb2Te5 and GeTe
J. Akola et al.
PHYSICAL REVIEW B (2007)
A polarizable high-rank quantum topological electrostatic potential developed using neural networks: Molecular dynamics simulations on the hydrogen fluoride dimer
S. Houlding et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2007)
Phase-change materials for rewriteable data storage
Matthias Wuttig et al.
NATURE MATERIALS (2007)
Coexistence of tetrahedral- and octahedral-like sites in amorphous phase change materials
S. Caravati et al.
APPLIED PHYSICS LETTERS (2007)
Ab initio molecular dynamics of hydrogen dissociation on metal surfaces using neural networks and novelty sampling
Jeffery Ludwig et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Representing molecule-surface interactions with symmetry-adapted neural networks
Jorg Behler et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Generalized neural-network representation of high-dimensional potential-energy surfaces
Joerg Behler et al.
PHYSICAL REVIEW LETTERS (2007)
Efficient and accurate Car-Parrinello-like approach to Born-Oppenheimer molecular dynamics
Thomas D. Kuhne et al.
PHYSICAL REVIEW LETTERS (2007)
Algorithm for three-dimensional Voronoi S-network
N. N. Medvedev et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2006)
A nested molecule-independent neural network approach for high-quality potential fits
S Manzhos et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals
M Krack
THEORETICAL CHEMISTRY ACCOUNTS (2005)
QUICKSTEP: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach
J VandeVondele et al.
COMPUTER PHYSICS COMMUNICATIONS (2005)
Ab initio potential-energy surfaces for complex, multichannel systems using modified novelty sampling and feedforward neural networks -: art. no. 084104
LM Raff et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Electronic switching in phase-change memories
A Pirovano et al.
IEEE TRANSACTIONS ON ELECTRON DEVICES (2004)
Time-reversible always stable predictor-corrector method for molecular dynamics of polarizable molecules
J Kolafa
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Representing high-dimensional potential-energy surfaces for reactions at surfaces by neural networks
S Lorenz et al.
CHEMICAL PHYSICS LETTERS (2004)
Morphology of voids in molecular systems. A Voronoi-Delaunay analysis of a simulated DMPC membrane
MG Alinchenko et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Predicting crystal structures:: The Parrinello-Rahman method revisited -: art. no. 075503
R Martonák et al.
PHYSICAL REVIEW LETTERS (2003)
Evidence of a reentrant Peierls distortion in liquid GeTe
JY Raty et al.
PHYSICAL REVIEW LETTERS (2000)
Share Paper
