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...

ENDOR Spectroscopy Reveals the “Free” 5′-Deoxyadenosyl Radical in a Radical SAM Enzyme Active Site Actually is Chaperoned by Close Interaction with the Methionine-Bound [4Fe–4S]2+ Cluster

Journal of the American Chemical Society, 2024-02, Vol.146 (6), p.3710-3720

2024

Volltextzugriff (PDF)

Thermal properties of single-layer MoS2–WS2 alloys enabled by machine-learned interatomic potentials

Chemical communications (Cambridge, England), 2022-06, Vol.58 (49), p.6902-6905

2022

Volltextzugriff (PDF)

Thermal properties of single-layer MoS 2 -WS 2 alloys enabled by machine-learned interatomic potentials

Chemical communications (Cambridge, England), 2022-06, Vol.58 (49), p.6902-6905

2022

Volltextzugriff (PDF)

Dinitrogen activation at chromium by photochemically induced Cr II -C bond homolysis

Chemical communications (Cambridge, England), 2024-07, Vol.60 (55), p.7029-7032

2024

Volltextzugriff (PDF)

Mechanism of Radical S‑Adenosyl- l-methionine Adenosylation: Radical Intermediates and the Catalytic Competence of the 5′-Deoxyadenosyl Radical

Journal of the American Chemical Society, 2022-03, Vol.144 (11), p.5087-5098

2022

Volltextzugriff (PDF)

Secondary structure determines electron transport in peptides

Proceedings of the National Academy of Sciences - PNAS, 2024-08, Vol.121 (32), p.e2403324121

2024

Volltextzugriff (PDF)

Investigation of p-type doping in β- and κ-Ga2O3

Journal of alloys and compounds, 2021-10, Vol.877, p.160227, Article 160227

2021

Volltextzugriff (PDF)

Halide-free synthesis of metastable graphitic BC 3

Chemical science (Cambridge), 2024-03, Vol.15 (12), p.4358-4363

2024

Volltextzugriff (PDF)

Atomic-Site-Specific Surface Valence-Band Structure from X-Ray Standing-Wave Excited Photoemission

Physical review letters, 2022-05, Vol.128 (20), p.206801-206801, Article 206801

2022

Volltextzugriff (PDF)

Front Cover: Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods (ChemPhysChem 5/2023)

Chemphyschem, 2023-03, Vol.24 (5), p.n/a

2023

Volltextzugriff (PDF)

ENDOR Spectroscopy Reveals the "Free" 5'-Deoxyadenosyl Radical in a Radical SAM Enzyme Active Site Actually is Chaperoned by Close Interaction with the Methionine-Bound 4Fe-4S2+ Cluster

Journal of the American Chemical Society, 2024-02, Vol.146 (6), p.3710

2024

Volltextzugriff (PDF)

Theoretical Analysis of the Nanoscale Composition, Tip-Enhanced Raman Spectroscopy, and Electronic Properties of Alloys in 2D MoS 2 –WS 2 Heterostructures

Journal of physical chemistry. C, 2022-06, Vol.126 (21), p.9099-9108

2022

Volltextzugriff (PDF)

Halide-free synthesis of metastable graphitic BC

Chemical science (Cambridge), 2024-03, Vol.15 (12), p.4358-4363

2024

Volltextzugriff (PDF)

Locally coupled open subsystems: A formalism for affordable electronic structure calculations featuring fractional charges and size consistency

The Journal of chemical physics, 2018-07, Vol.149 (3)

2018

Volltextzugriff (PDF)

Second Linear Response Theory and the Analytic Calculation of Excited-State Properties

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-01, Vol.125 (4)

2021

Volltextzugriff (PDF)

Photoinduced Anomalous Coulomb Blockade and the Role of Triplet States in Electron Transport through an Irradiated Molecular Transistor

Nano letters, 2018-07, Vol.18 (8)

2018

Volltextzugriff (PDF)

Quantum embedding for material chemistry based on domain separation and open subsystems

International journal of quantum chemistry, 2020-02

2020

Volltextzugriff (PDF)

Creating a three-dimensional intrinsic electric dipole on rotated CrI 3 bilayers

Physical review. B, 2023-05, Vol.107 (19), Article 195128

2023

Volltextzugriff (PDF)

Anomalous Temperature and Polarization Dependences of Photoluminescence of Metal‐Organic Chemical Vapor Deposition‐Grown GeSe 2

Advanced optical materials, 2024-01, Vol.12 (2)

2024

Volltextzugriff (PDF)

Thermal properties of single-layer MoS-WS alloys enabled by machine-learned interatomic potentials

Chemical communications (Cambridge, England), 2022-06, Vol.58 (49), p.692-695

2022

Volltextzugriff (PDF)

Photophysical implications of ring fusion, linker length, and twisting angle in a series of perylenediimide–thienoacene dimers† †Electronic supplementary information (ESI) available. See DOI: 10.1039/d0sc02862b

Chemical science (Cambridge), 2020-07, Vol.11 (27), p.7133-7143

2020

Volltextzugriff (PDF)

Atom vacancies and electronic transmission Stark effects in boron nanoflake junctions

Journal of materials chemistry. C, Materials for optical and electronic devices, 2020-07, Vol.8 (43)

2020

Volltextzugriff (PDF)

Sequential double excitations from linear-response time-dependent density functional theory

The Journal of chemical physics, 2016-05, Vol.144 (20)

2016

Volltextzugriff (PDF)

Corrigendum to “Accurate correlation, thermochemistry, and structural interpretation of equilibrium adsorption isotherms of water vapor in zeolite 3A by means of a generalized statistical thermodynamic adsorption model” [Fluid Phase Equilibr. 283 (2009) 73–88]

Fluid phase equilibria, 2010-12, Vol.299 (2), p.305-305

2010

Volltextzugriff (PDF)

Development of formalisms based on locally coupled open subsystems for calculations in molecular electronic structure and dynamics

Physical review. A, 2018-12, Vol.98 (6)

2018

Volltextzugriff (PDF)

1 – 25 von 255

Suche als RSS-Feed

Aktive Filter

ThemaScience & Technology

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(183)
Mit Volltextzugriff
(206)

Publikationsform

2 weitere anzeigen...

Weniger anzeigen...

Sprache

Erscheinungsjahr

n.n

Thema

Humans
(21)
Female
(12)
Male
(11)
Adult
(10)
Aged
(8)
Health Policy & Services
(7)
Middle Aged
(7)
Spain
(7)
Psychology
(6)
Public, Environmental & Occupational Health
(6)
Health
(5)
Health Care Sciences & Services
(5)
Infectious Diseases
(5)
Demography
(4)
Density Functional Theory
(4)
España
(4)
Indicators
(4)
Inorganic, Organic, Physical, And Analytical Chemistry
(4)
Older Adults
(4)
Pediatrics
(4)

15 weitere anzeigen...

Weniger anzeigen...

Zeitschrift / Serie

5 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

Menü

Weitere Dienste

Einstellungen

ENDOR Spectroscopy Reveals the “Free” 5′-Deoxyadenosyl Radical in a Radical SAM Enzyme Active Site Actually is Chaperoned by Close Interaction with the Methionine-Bound [4Fe–4S]2+ Cluster

Thermal properties of single-layer MoS2–WS2 alloys enabled by machine-learned interatomic potentials

Thermal properties of single-layer MoS 2 -WS 2 alloys enabled by machine-learned interatomic potentials

Dinitrogen activation at chromium by photochemically induced Cr II -C bond homolysis

Mechanism of Radical S‑Adenosyl- l-methionine Adenosylation: Radical Intermediates and the Catalytic Competence of the 5′-Deoxyadenosyl Radical

Secondary structure determines electron transport in peptides

Investigation of p-type doping in β- and κ-Ga2O3

Halide-free synthesis of metastable graphitic BC 3

Atomic-Site-Specific Surface Valence-Band Structure from X-Ray Standing-Wave Excited Photoemission

Front Cover: Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods (ChemPhysChem 5/2023)

ENDOR Spectroscopy Reveals the "Free" 5'-Deoxyadenosyl Radical in a Radical SAM Enzyme Active Site Actually is Chaperoned by Close Interaction with the Methionine-Bound 4Fe-4S2+ Cluster

Theoretical Analysis of the Nanoscale Composition, Tip-Enhanced Raman Spectroscopy, and Electronic Properties of Alloys in 2D MoS 2 –WS 2 Heterostructures

Halide-free synthesis of metastable graphitic BC

Locally coupled open subsystems: A formalism for affordable electronic structure calculations featuring fractional charges and size consistency

Second Linear Response Theory and the Analytic Calculation of Excited-State Properties

Photoinduced Anomalous Coulomb Blockade and the Role of Triplet States in Electron Transport through an Irradiated Molecular Transistor

Quantum embedding for material chemistry based on domain separation and open subsystems

Creating a three-dimensional intrinsic electric dipole on rotated CrI 3 bilayers

Anomalous Temperature and Polarization Dependences of Photoluminescence of Metal‐Organic Chemical Vapor Deposition‐Grown GeSe 2

Thermal properties of single-layer MoS-WS alloys enabled by machine-learned interatomic potentials

Photophysical implications of ring fusion, linker length, and twisting angle in a series of perylenediimide–thienoacene dimers† †Electronic supplementary information (ESI) available. See DOI: 10.1039/d0sc02862b

Atom vacancies and electronic transmission Stark effects in boron nanoflake junctions

Sequential double excitations from linear-response time-dependent density functional theory

Corrigendum to “Accurate correlation, thermochemistry, and structural interpretation of equilibrium adsorption isotherms of water vapor in zeolite 3A by means of a generalized statistical thermodynamic adsorption model” [Fluid Phase Equilibr. 283 (2009) 73–88]

Development of formalisms based on locally coupled open subsystems for calculations in molecular electronic structure and dynamics

Aktive Filter

Suchergebnisse filtern