UB Paderborn / Katalog / Suche / in CDI

1 – 25 von 271

Sortiert nach

High-throughput computational design of organic-inorganic hybrid halide semiconductors beyond perovskites for optoelectronics

Energy & environmental science, 2019-01, Vol.12 (7), p.2233-2243

2019

Link zum Volltext

Verfügbarkeit prüfen

Enhancing interfacial conductivity and spatial charge confinement of LaAlO3/SrTiO3 heterostructures via strain engineering

Applied physics letters, 2014-10, Vol.105 (14)

2014

Link zum Volltext

Verfügbarkeit prüfen

A RESTful API for exchanging materials data in the AFLOWLIB.org consortium

Computational materials science, 2014-10, Vol.93 (C), p.178-192

2014

Link zum Volltext

Verfügbarkeit prüfen

2D Hybrid Halide Perovskites: Synthesis, Properties, and Applications

Solar RRL, 2021-01, Vol.5 (1), p.n/a

2021

Link zum Volltext

Verfügbarkeit prüfen

AFLOWLIB.ORG: A distributed materials properties repository from high-throughput ab initio calculations

Computational materials science, 2012-06, Vol.58 (C), p.227-235

2012

Link zum Volltext

Verfügbarkeit prüfen

Density Functional Characterization of the Visible-Light Absorption in Substitutional C-Anion- and C-Cation-Doped TiO2

Journal of physical chemistry. C, 2009-02, Vol.113 (6), p.2624-2629

2009

Link zum Volltext

Verfügbarkeit prüfen

High-throughput design of perpendicular magnetic anisotropy at quaternary Heusler and MgO interfaces

npj computational materials, 2023-07, Vol.9 (1), p.123-8, Article 123

2023

Link zum Volltext

Verfügbarkeit prüfen

Electronic structures and formation energies of pentavalent-ion-doped SnO2: First-principles hybrid functional calculations

Journal of applied physics, 2015-05, Vol.117 (17)

2015

Link zum Volltext

Verfügbarkeit prüfen

AFLOW: An automatic framework for high-throughput materials discovery

Computational materials science, 2012-06, Vol.58, p.218-226

2012

Link zum Volltext

Verfügbarkeit prüfen

Density Functional Characterization of the Visible-Light Absorption in Substitutional C-Anion- and C-Cation-Doped TiO 2

Journal of physical chemistry. C, 2009-02, Vol.113 (6), p.2624-2629

2009

Link zum Volltext

Verfügbarkeit prüfen

Preparation, electronic structure, and photocatalytic properties of Bi2O2CO3 nanosheet

Applied surface science, 2010-10, Vol.257 (1), p.172-175

2010

Link zum Volltext

Verfügbarkeit prüfen

Theoretical Study of N-Doped TiO2 Rutile Crystals

The journal of physical chemistry. B, 2006-11, Vol.110 (47), p.24011-24014

2006

Link zum Volltext

Verfügbarkeit prüfen

Review of First-Principles Studies of TiO2: Nanocluster, Bulk, and Material Interface

Catalysts, 2020-09, Vol.10 (9), p.972

2020

Link zum Volltext

Verfügbarkeit prüfen

High-mobility two-dimensional electron gas in SrGeO3- and BaSnO3-based perovskite oxide heterostructures: an ab initio study

Physical chemistry chemical physics : PCCP, 2016-01, Vol.18 (46), p.31924-31929

2016

Link zum Volltext

Verfügbarkeit prüfen

Density Functional Characterization of the Band Edges, the Band Gap States, and the Preferred Doping Sites of Halogen-Doped TiO2

Chemistry of materials, 2008-10, Vol.20 (20), p.6528-6534

2008

Link zum Volltext

Verfügbarkeit prüfen

Fractional-unit-cell-doped spinel/perovskite oxide interfaces with switchable carrier conduction

Applied physics letters, 2022-09, Vol.121 (11)

2022

Link zum Volltext

Verfügbarkeit prüfen

Towards enhancing two-dimensional electron gas quantum confinement effects in perovskite oxide heterostructures

Journal of applied physics, 2015-03, Vol.117 (11)

2015

Link zum Volltext

Verfügbarkeit prüfen

Review of high-throughput computational design of Heusler alloys

Journal of alloys and compounds, 2021-06, Vol.867, p.158854, Article 158854

2021

Link zum Volltext

Verfügbarkeit prüfen

First-Principles Investigation of Size Effects on Cohesive Energies of Transition-Metal Nanoclusters

Nanomaterials (Basel, Switzerland), 2023-08, Vol.13 (16), p.2356

2023

Link zum Volltext

Verfügbarkeit prüfen

First-Principles Hybrid Functional Study of the Organic–Inorganic Perovskites CH3NH3SnBr3 and CH3NH3SnI3

Journal of physical chemistry. C, 2014-10, Vol.118 (42), p.24383-24388

2014

Link zum Volltext

Verfügbarkeit prüfen

Density Functional Characterization of the Electronic Structure and Visible‐Light Absorption of Cr‐Doped Anatase TiO2

Chemphyschem, 2009-09, Vol.10 (13), p.2327-2333

2009

Link zum Volltext

Verfügbarkeit prüfen

Elucidate interfacial disorder effects on the perpendicular magnetic anisotropy at Fe/MgO heterostructure from first-principles calculations

Journal of physics. Condensed matter, 2022-05, Vol.34 (21), p.214009

2022

Link zum Volltext

Verfügbarkeit prüfen

Heusler alloys: Past, properties, new alloys, and prospects

Progress in materials science, 2023-02, Vol.132, p.101017, Article 101017

2023

Link zum Volltext

Verfügbarkeit prüfen

High‐throughput computational design of halide perovskites and beyond for optoelectronics

Wiley interdisciplinary reviews. Computational molecular science, 2021-05, Vol.11 (3), p.e1500-n/a

2021

Link zum Volltext

Verfügbarkeit prüfen

Modeling Off-Stoichiometry Materials with a High-Throughput Ab-Initio Approach

Chemistry of materials, 2016-09, Vol.28 (18), p.6484-6492

2016

Link zum Volltext

Verfügbarkeit prüfen

1 – 25 von 271

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(251)
Mit Volltextzugriff
(262)

Publikationsform

Sprache

Englisch
(267)
Japanisch
(21)
Deutsch
(1)

Erscheinungsjahr

n.n

Thema

Science & Technology
(154)
Physical Sciences
(95)
Technology
(92)
Materials Science
(82)
Chemistry
(68)
Materials Science, Multidisciplinary
(68)
Physics
(51)
Chemistry, Physical
(49)
Science & Technology - Other Topics
(41)
Nanoscience & Nanotechnology
(36)
Physics, Applied
(28)
Chemistry, Multidisciplinary
(24)
Life Sciences & Biomedicine
(21)
First Principles
(19)
Engineering
(18)
Physics, Condensed Matter
(16)
Substrates
(14)
First-Principles
(13)
Physics, Atomic, Molecular & Chemical
(13)
Humans
(12)

15 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 90 Tagen
(5)

Menü

Weitere Dienste

Einstellungen

High-throughput computational design of organic-inorganic hybrid halide semiconductors beyond perovskites for optoelectronics

Enhancing interfacial conductivity and spatial charge confinement of LaAlO3/SrTiO3 heterostructures via strain engineering

A RESTful API for exchanging materials data in the AFLOWLIB.org consortium

2D Hybrid Halide Perovskites: Synthesis, Properties, and Applications

AFLOWLIB.ORG: A distributed materials properties repository from high-throughput ab initio calculations

Density Functional Characterization of the Visible-Light Absorption in Substitutional C-Anion- and C-Cation-Doped TiO2

High-throughput design of perpendicular magnetic anisotropy at quaternary Heusler and MgO interfaces

Electronic structures and formation energies of pentavalent-ion-doped SnO2: First-principles hybrid functional calculations

AFLOW: An automatic framework for high-throughput materials discovery

Density Functional Characterization of the Visible-Light Absorption in Substitutional C-Anion- and C-Cation-Doped TiO 2

Preparation, electronic structure, and photocatalytic properties of Bi2O2CO3 nanosheet

Theoretical Study of N-Doped TiO2 Rutile Crystals

Review of First-Principles Studies of TiO2: Nanocluster, Bulk, and Material Interface

High-mobility two-dimensional electron gas in SrGeO3- and BaSnO3-based perovskite oxide heterostructures: an ab initio study

Density Functional Characterization of the Band Edges, the Band Gap States, and the Preferred Doping Sites of Halogen-Doped TiO2

Fractional-unit-cell-doped spinel/perovskite oxide interfaces with switchable carrier conduction

Towards enhancing two-dimensional electron gas quantum confinement effects in perovskite oxide heterostructures

Review of high-throughput computational design of Heusler alloys

First-Principles Investigation of Size Effects on Cohesive Energies of Transition-Metal Nanoclusters

First-Principles Hybrid Functional Study of the Organic–Inorganic Perovskites CH3NH3SnBr3 and CH3NH3SnI3

Density Functional Characterization of the Electronic Structure and Visible‐Light Absorption of Cr‐Doped Anatase TiO2

Elucidate interfacial disorder effects on the perpendicular magnetic anisotropy at Fe/MgO heterostructure from first-principles calculations

Heusler alloys: Past, properties, new alloys, and prospects

High‐throughput computational design of halide perovskites and beyond for optoelectronics

Modeling Off-Stoichiometry Materials with a High-Throughput Ab-Initio Approach

Suchergebnisse filtern