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Vibrational and optical properties of MoS2: From monolayer to bulk

Surface science reports, 2015-12, Vol.70 (4), p.554-586

2015

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Heyd-Scuseria-Ernzerhof hybrid functional for calculating the lattice dynamics of semiconductors

Physical review. B, Condensed matter and materials physics, 2009-09, Vol.80 (11), Article 115205

2009

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Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Journal of physics. Condensed matter, 2021-01, Vol.33 (1), p.015901-015901

2021

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Accurate band structures and effective masses for InP, InAs, and InSb using hybrid functionals

Physical review. B, Condensed matter and materials physics, 2009-07, Vol.80 (3), Article 035203

2009

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Calculations of ZnO properties using the Heyd-Scuseria-Ernzerhof screened hybrid density functional

Physical review. B, Condensed matter and materials physics, 2009-10, Vol.80 (15), Article 155124

2009

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Lowest optical excitations in molecular crystals: bound excitons versus free electron-hole pairs in anthracene

Physical review letters, 2004-04, Vol.92 (14), p.147402-147402, Article 147402

2004

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Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS2

Physical review. B, Condensed matter and materials physics, 2013-07, Vol.88, p.045412-1-6

2013

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Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS 2 , MoSe 2 , WS 2 , and WSe 2

Physical review. B, Condensed matter and materials physics, 2014-02, Vol.89 (7), Article 075409

2014

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Structural and electronic properties of lead chalcogenides from first principles

Physical review. B, Condensed matter and materials physics, 2007-05, Vol.75 (19), Article 195211

2007

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High pressure x-ray study on anthracene

The Journal of chemical physics, 2003-07, Vol.119 (2), p.1078-1084

2003

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Phase transition and electronic properties of fluorene: A joint experimental and theoretical high-pressure study

Physical review. B, Condensed matter and materials physics, 2006-01, Vol.73 (2), Article 024109

2006

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Oligoacene exciton binding energies : Their dependence on molecular size

Physical review. B, Condensed matter and materials physics, 2005-02, Vol.71 (8), p.081202.1-081202.4, Article 081202

2005

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UV–Vis and Photoluminescence Spectroscopy to Understand the Coordination of Cu Cations in the Zeolite SSZ-13

Chemistry of materials, 2019-12, Vol.31 (23), p.9582-9592

2019

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Ab initio study of anthracene under high pressure

Physical review. B, Condensed matter, 2003-05, Vol.67 (18), Article 184105

2003

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Electronic properties of oligoacenes from first principles

Physical review. B, Condensed matter and materials physics, 2005-11, Vol.72 (20), p.205205.1-205205.10, Article 205205

2005

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Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS sub(2), MoSe sub(2), WS sub(2), and WSe sub(2)

Physical review. B, Condensed matter and materials physics, 2014-02, Vol.89 (7)

2014

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AB-INITIO STUDY ON THE EXCITON BINDING ENERGIES IN ORGANIC SEMICONDUCTORS

Modern physics letters. B, Condensed matter physics, statistical physics, applied physics, 2006-03, Vol.20 (6), p.261-280

2006

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Excitonic Effects in Anthracene under High Pressure from First Principles

Physica scripta, 2004-01, Vol.2004, p.152

2004

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Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS sub(2)

Physical review. B, Condensed matter and materials physics, 2013-07, Vol.88 (4)

2013

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Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS 2

Physical review. B, Condensed matter and materials physics, 2013-07, Vol.88 (4), Article 045412

2013

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Nonlinear behavior of the band gap of Pb 1 − x Eu x Se ( 0 ≤ x ≤ 1 ) from first principles

Physical review. B, Condensed matter and materials physics, 2008-10, Vol.78 (16), Article 165103

2008

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Electronic, optical, and structural properties of oligophenylene molecular crystals under high pressure: An ab initio investigation

Physical review. B, Condensed matter, 2003-06, Vol.67 (23), Article 235321

2003

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The Crystal Sructure of Anthracene up to 22 GPa: a X-ray Diffraction Study

MRS proceedings, 2003, Vol.771, Article L7.11

2003

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Phase transition and electronic properties of fluorene: A joint experimental and theoretical high-pressure study

Physical review. B, Condensed matter and materials physics, 2006-01, Vol.73 (2)

2006

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Verwaltung von Kultur-Artefakten: Herausforderungen bei der Realisierung typischer Einsatzszenarien in Kulturerbe-Archiven

Wissensbasierte KI-Anwendungen, 2023, p.245-258

2023

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Vibrational and optical properties of MoS2: From monolayer to bulk

Heyd-Scuseria-Ernzerhof hybrid functional for calculating the lattice dynamics of semiconductors

Cation interstitial diffusion in lead telluride and cadmium telluride studied by means of neural network potential based molecular dynamics simulations

Accurate band structures and effective masses for InP, InAs, and InSb using hybrid functionals

Calculations of ZnO properties using the Heyd-Scuseria-Ernzerhof screened hybrid density functional

Lowest optical excitations in molecular crystals: bound excitons versus free electron-hole pairs in anthracene

Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS2

Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS 2 , MoSe 2 , WS 2 , and WSe 2

Structural and electronic properties of lead chalcogenides from first principles

High pressure x-ray study on anthracene

Phase transition and electronic properties of fluorene: A joint experimental and theoretical high-pressure study

Oligoacene exciton binding energies : Their dependence on molecular size

UV–Vis and Photoluminescence Spectroscopy to Understand the Coordination of Cu Cations in the Zeolite SSZ-13

Ab initio study of anthracene under high pressure

Electronic properties of oligoacenes from first principles

Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides MoS sub(2), MoSe sub(2), WS sub(2), and WSe sub(2)

AB-INITIO STUDY ON THE EXCITON BINDING ENERGIES IN ORGANIC SEMICONDUCTORS

Excitonic Effects in Anthracene under High Pressure from First Principles

Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS sub(2)

Effect of spin-orbit interaction on the optical spectra of single-layer, double-layer, and bulk MoS 2

Nonlinear behavior of the band gap of Pb 1 − x Eu x Se ( 0 ≤ x ≤ 1 ) from first principles

Electronic, optical, and structural properties of oligophenylene molecular crystals under high pressure: An ab initio investigation

The Crystal Sructure of Anthracene up to 22 GPa: a X-ray Diffraction Study

Phase transition and electronic properties of fluorene: A joint experimental and theoretical high-pressure study

Verwaltung von Kultur-Artefakten: Herausforderungen bei der Realisierung typischer Einsatzszenarien in Kulturerbe-Archiven

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