UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

Phase stability of the tin monochalcogenides SnS and SnSe: a quasi-harmonic lattice-dynamics study

Physical chemistry chemical physics : PCCP, 2021-09, Vol.23 (35), p.19219-19236

2021

Volltextzugriff (PDF)

Approximate models for the lattice thermal conductivity of alloy thermoelectrics

Journal of materials chemistry. C, Materials for optical and electronic devices, 2021-09, Vol.9 (35), p.11772-11787

Skelton, Jonathan M

2021

Volltextzugriff (PDF)

Towards the high-throughput prediction of finite-temperature properties using the quasi-harmonic approximation

Journal of physics. Condensed matter, 2024-05, Vol.36 (20), p.205501

2024

Volltextzugriff (PDF)

Thermal physics of the lead chalcogenides PbS, PbSe, and PbTe from first principles

Physical review. B, Condensed matter and materials physics, 2014-05, Vol.89 (20), Article 205203

2014

Volltextzugriff (PDF)

Spontaneous Octahedral Tilting in the Cubic Inorganic Cesium Halide Perovskites CsSnX3 and CsPbX3 (X = F, Cl, Br, I)

The journal of physical chemistry letters, 2017-10, Vol.8 (19), p.4720-4726

2017

Volltextzugriff (PDF)

Lattice dynamics and vibrational spectra of the orthorhombic, tetragonal, and cubic phases of methylammonium lead iodide

Physical review. B, Condensed matter and materials physics, 2015-10, Vol.92 (14), Article 144308

2015

Volltextzugriff (PDF)

The physical significance of imaginary phonon modes in crystals

Electronic Structure, 2022-09, Vol.4 (3), p.33002

2022

Volltextzugriff (PDF)

Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport

Physical chemistry chemical physics : PCCP, 2017-05, Vol.19 (19), p.12452-12465

2017

Volltextzugriff (PDF)

Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors

The Journal of chemical physics, 2015-08, Vol.143 (6), p.064710-064710

2015

Volltextzugriff (PDF)

Assessment of dynamic structural instabilities across 24 cubic inorganic halide perovskites

The Journal of chemical physics, 2020-01, Vol.152 (2), p.024703-024703

2020

Volltextzugriff (PDF)

Construction of a Gaussian Process Regression Model of Formamide for Use in Molecular Simulations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-02, Vol.127 (7), p.1702-1714

2023

Volltextzugriff (PDF)

Low-frequency optical phonon modes and carrier mobility in the halide perovskite CH3NH3PbBr3 using terahertz time-domain spectroscopy

Applied physics letters, 2017-11, Vol.111 (20)

2017

Volltextzugriff (PDF)

Anharmonicity in the High-Temperature Cmcm Phase of SnSe: Soft Modes and Three-Phonon Interactions

Physical review letters, 2016-08, Vol.117 (7), p.075502-075502

2016

Volltextzugriff (PDF)

Dynamic disorder, phonon lifetimes, and the assignment of modes to the vibrational spectra of methylammonium lead halide perovskites

Physical chemistry chemical physics : PCCP, 2016-10, Vol.18 (39), p.27051-27066

2016

Volltextzugriff (PDF)

Application of the FFLUX Force Field to Molecular Crystals: A Study of Formamide

Journal of chemical theory and computation, 2023-11, Vol.19 (21), p.7946-7959

2023

Volltextzugriff (PDF)

Incorporating Noncovalent Interactions in Transfer Learning Gaussian Process Regression Models for Molecular Simulations

Journal of chemical theory and computation, 2024-07, Vol.20 (14), p.5994-6008

2024

Volltextzugriff (PDF)

Accuracy of Hybrid Functionals with Non-Self-Consistent Kohn-Sham Orbitals for Predicting the Properties of Semiconductors

Journal of chemical theory and computation, 2020-06, Vol.16 (6), p.3543-3557

2020

Volltextzugriff (PDF)

Highly Anisotropic Thermal Transport in LiCoO2

The journal of physical chemistry letters, 2019-09, Vol.10 (18), p.5552-5556

2019

Volltextzugriff (PDF)

Monitoring photo-induced population dynamics in metastable linkage isomer crystals: a crystallographic kinetic study of [Pd(Bu4dien)NO2]BPh4

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (8), p.5874-5886

2018

Volltextzugriff (PDF)

Quantum Confined High-Entropy Lanthanide Oxysulfide Colloidal Nanocrystals

Nano letters, 2022-10, Vol.22 (20), p.8045-8051

2022

Volltextzugriff (PDF)

A general forcefield for accurate phonon properties of metal-organic frameworks

Physical chemistry chemical physics : PCCP, 2016, Vol.18 (42), p.29316-29329

2016

Volltextzugriff (PDF)

Composition-dependent morphologies of CeO2 nanoparticles in the presence of Co-adsorbed H2O and CO2: a density functional theory study

Nanoscale, 2024-06, Vol.16 (23), p.11232-11249

2024

Volltextzugriff (PDF)

Atomistic Origin of the Enhanced Crystallization Speed and n-Type Conductivity in Bi-doped Ge-Sb-Te Phase-Change Materials

Advanced functional materials, 2014-12, Vol.24 (46), p.7291-7300

2014

Volltextzugriff (PDF)

Towards an atomistic understanding of polymorphism in molecular solids

Physical chemistry chemical physics : PCCP, 2022-05, Vol.24 (18), p.11278-11294

2022

Volltextzugriff (PDF)

Use of Interplay between A‐Site Non‐Stoichiometry and Hydroxide Doping to Deliver Novel Proton‐Conducting Perovskite Oxides

Advanced energy materials, 2021-11, Vol.11 (44)

2021

Volltextzugriff (PDF)

1 – 25 von 39

Suche als RSS-Feed

Aktive Filter

ThemaPhysics

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(39)
Mit Volltextzugriff
(39)

Publikationsform

Artikel
(39)

Sprache

Englisch
(39)
Japanisch
(8)

Erscheinungsjahr

n.n

Thema

Physical Sciences
(38)
Science & Technology
(38)
Chemistry
(26)
Chemistry, Physical
(24)
Materials Science
(22)
Technology
(22)
Materials Science, Multidisciplinary
(21)
Physics, Applied
(19)
Physics, Atomic, Molecular & Chemical
(15)
Physics, Condensed Matter
(12)
Nanoscience & Nanotechnology
(10)
Science & Technology - Other Topics
(10)
Electronic Structure
(7)
First Principles
(6)
Phonons
(6)
Chemistry, Multidisciplinary
(5)
Crystal Structure
(5)
Density Functional Theory
(4)
Doping
(4)

14 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 90 Tagen
(2)

Menü

Weitere Dienste

Einstellungen

Phase stability of the tin monochalcogenides SnS and SnSe: a quasi-harmonic lattice-dynamics study

Approximate models for the lattice thermal conductivity of alloy thermoelectrics

Towards the high-throughput prediction of finite-temperature properties using the quasi-harmonic approximation

Thermal physics of the lead chalcogenides PbS, PbSe, and PbTe from first principles

Spontaneous Octahedral Tilting in the Cubic Inorganic Cesium Halide Perovskites CsSnX3 and CsPbX3 (X = F, Cl, Br, I)

Lattice dynamics and vibrational spectra of the orthorhombic, tetragonal, and cubic phases of methylammonium lead iodide

The physical significance of imaginary phonon modes in crystals

Lattice dynamics of the tin sulphides SnS2, SnS and Sn2S3: vibrational spectra and thermal transport

Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors

Assessment of dynamic structural instabilities across 24 cubic inorganic halide perovskites

Construction of a Gaussian Process Regression Model of Formamide for Use in Molecular Simulations

Low-frequency optical phonon modes and carrier mobility in the halide perovskite CH3NH3PbBr3 using terahertz time-domain spectroscopy

Anharmonicity in the High-Temperature Cmcm Phase of SnSe: Soft Modes and Three-Phonon Interactions

Dynamic disorder, phonon lifetimes, and the assignment of modes to the vibrational spectra of methylammonium lead halide perovskites

Application of the FFLUX Force Field to Molecular Crystals: A Study of Formamide

Incorporating Noncovalent Interactions in Transfer Learning Gaussian Process Regression Models for Molecular Simulations

Accuracy of Hybrid Functionals with Non-Self-Consistent Kohn-Sham Orbitals for Predicting the Properties of Semiconductors

Highly Anisotropic Thermal Transport in LiCoO2

Monitoring photo-induced population dynamics in metastable linkage isomer crystals: a crystallographic kinetic study of [Pd(Bu4dien)NO2]BPh4

Quantum Confined High-Entropy Lanthanide Oxysulfide Colloidal Nanocrystals

A general forcefield for accurate phonon properties of metal-organic frameworks

Composition-dependent morphologies of CeO2 nanoparticles in the presence of Co-adsorbed H2O and CO2: a density functional theory study

Atomistic Origin of the Enhanced Crystallization Speed and n-Type Conductivity in Bi-doped Ge-Sb-Te Phase-Change Materials

Towards an atomistic understanding of polymorphism in molecular solids

Use of Interplay between A‐Site Non‐Stoichiometry and Hydroxide Doping to Deliver Novel Proton‐Conducting Perovskite Oxides

Aktive Filter

Suchergebnisse filtern