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...

Theoretical quantum model of two-dimensional propagating plexcitons

The Journal of chemical physics, 2022-09, Vol.157 (12), p.124103-124103

2022

Volltextzugriff (PDF)

Second response theory: a theoretical formalism for the propagation of quantum superpositions

Electronic Structure, 2023-12, Vol.5 (4), p.45001

Mosquera, Martín A

2023

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, 2021-02, Vol.125 (4), p.1093-1102

2021

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)

Virial relations in density embedding

International journal of quantum chemistry, 2020-11, Vol.120 (21), p.n/a

2020

Volltextzugriff (PDF)

Charge Transport and Thermoelectric Properties of Carbon Sulfide Nanobelts in Single-Molecule Sensors

Chemistry of materials, 2019-09, Vol.31 (17), p.6506-6518

2019

Volltextzugriff (PDF)

Orbital Control and Coherent Charge Transport in Transition Metal Platinum(II)–Platinum(II) Lantern Complexes in Molecular Junctions

Journal of physical chemistry. C, 2020-02, Vol.124 (5), p.3233-3241

2020

Volltextzugriff (PDF)

Domain Separated Density Functional Theory for Reaction Energy Barriers and Optical Excitations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-07, Vol.124 (28), p.5954-5962

2020

Volltextzugriff (PDF)

Germanium Fluoride Nanocages as Optically Transparent n‑Type Materials and Their Endohedral Metallofullerene Derivatives

Journal of the American Chemical Society, 2019-01, Vol.141 (4), p.1672-1684

2019

Volltextzugriff (PDF)

Halide-free synthesis of metastable graphitic BC 3

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

2024

Volltextzugriff (PDF)

Halide-free synthesis of metastable graphitic BC3

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

2024

Volltextzugriff (PDF)

Time-Dependent Electronic Populations in Fragment-Based Time-Dependent Density Functional Theory

Journal of chemical theory and computation, 2015-08, Vol.11 (8), p.3530-3536

2015

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)

Phonon Dispersion Relation of Bulk Boron-Doped Graphitic Carbon

Journal of physical chemistry. C, 2020-10, Vol.124 (42), p.23027-23037

2020

Volltextzugriff (PDF)

Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods

Chemphyschem, 2023-03, Vol.24 (5), p.e202200592-n/a

2023

Volltextzugriff (PDF)

Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods

Chemphyschem, 2023-03, Vol.24 (5), p.e202300081-n/a

2023

Volltextzugriff (PDF)

Derivative discontinuities in density functional theory

Molecular physics, 2014-12, Vol.112 (23), p.2997-3013

2014

Volltextzugriff (PDF)

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

International journal of quantum chemistry, 2020-11, Vol.120 (21), p.n/a

2020

Volltextzugriff (PDF)

Exciton Absorption Spectra by Linear Response Methods: Application to Conjugated Polymers

Journal of the American Chemical Society, 2017-03, Vol.139 (10), p.3728-3735

2017

Volltextzugriff (PDF)

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

The Journal of chemical physics, 2016-05, Vol.144 (20), p.204105-204105

2016

Volltextzugriff (PDF)

Fragment-based time-dependent density functional theory

Physical review letters, 2013-07, Vol.111 (2), p.023001-023001, Article 023001

2013

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), p.034105-034105

2018

Volltextzugriff (PDF)

Connection between Hybrid Functionals and Importance of the Local Density Approximation

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2016-03, Vol.120 (9), p.1605-1612

2016

Volltextzugriff (PDF)

Partition density functional theory and its extension to the spin-polarized case

Molecular physics, 2013-02, Vol.111 (4), p.505-515

2013

Volltextzugriff (PDF)

26 – 50 von 505

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(419)
Mit Volltextzugriff
(434)

Publikationsform

2 weitere anzeigen...

Weniger anzeigen...

Sprache

Erscheinungsjahr

n.n

Thema

Science & Technology
(250)
Life Sciences & Biomedicine
(155)
Humans
(121)
Physical Sciences
(82)
Chemistry
(70)
Male
(70)
Female
(65)
Middle Aged
(49)
Chemistry, Physical
(47)
Physics
(40)
Aged
(38)
Technology
(35)
Adult
(33)
Oncology
(30)
Chemistry, Multidisciplinary
(27)
Materials Science
(27)
Physics, Atomic, Molecular & Chemical
(26)
Biological And Medical Sciences
(24)
Science & Technology - Other Topics
(24)
Cardiovascular System & Cardiology
(23)

15 weitere anzeigen...

Weniger anzeigen...

Kollektion

EZB Electronic Journals Library
(238)
Ingenta
(197)
Elsevier ScienceDirect Journals Complete
(135)
MEDLINE
(133)
IngentaConnect Journals
(88)
Journals@Ovid Full Text
(80)
Publisher or Other Site
(52)
Wiley Online Library Journals
(45)
Wiley Online Library
(32)
Elsevier Journal Backfiles on ScienceDirect (DFG Nationallizenzen)
(31)
Oxford Journals
(21)
Oxford Journals 2020 Medicine
(19)
Nature Journals
(16)
Springer Journals
(15)
Nexis Uni
(14)
Ebook Central Perpetual and DDA
(12)
eBooks on EBSCOhost
(10)
American Physical Society Journals
(8)
EZB-NALI2-00462 Springer Archive NL
(7)
JSTOR
(7)

15 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

Menü

Weitere Dienste

Einstellungen

Theoretical quantum model of two-dimensional propagating plexcitons

Second response theory: a theoretical formalism for the propagation of quantum superpositions

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

Secondary structure determines electron transport in peptides

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

Virial relations in density embedding

Charge Transport and Thermoelectric Properties of Carbon Sulfide Nanobelts in Single-Molecule Sensors

Orbital Control and Coherent Charge Transport in Transition Metal Platinum(II)–Platinum(II) Lantern Complexes in Molecular Junctions

Domain Separated Density Functional Theory for Reaction Energy Barriers and Optical Excitations

Germanium Fluoride Nanocages as Optically Transparent n‑Type Materials and Their Endohedral Metallofullerene Derivatives

Halide-free synthesis of metastable graphitic BC 3

Halide-free synthesis of metastable graphitic BC3

Time-Dependent Electronic Populations in Fragment-Based Time-Dependent Density Functional Theory

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

Phonon Dispersion Relation of Bulk Boron-Doped Graphitic Carbon

Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods

Cluster Amplitudes and Their Interplay with Self‐Consistency in Density Functional Methods

Derivative discontinuities in density functional theory

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

Exciton Absorption Spectra by Linear Response Methods: Application to Conjugated Polymers

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

Fragment-based time-dependent density functional theory

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

Connection between Hybrid Functionals and Importance of the Local Density Approximation

Partition density functional theory and its extension to the spin-polarized case

Suchergebnisse filtern