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...

Electronic structure of spin-singlet and spin-triplet atomic carbon upon interaction with helium. A theoretical investigation

Chemical physics letters, 2023-09, Vol.826, p.140674, Article 140674

Cargnoni, Fausto

2023

Volltextzugriff (PDF)

Thermodynamic Stability and Electronic Properties of Graphene Nanoflakes

C (Basel), 2024-03, Vol.10 (1), p.5

2024

Volltextzugriff (PDF)

New Insight into the Electronic and Magnetic Properties of Sub-Stoichiometric WO3: A Theoretical Perspective

Crystals (Basel), 2024-04, Vol.14 (4), p.372

2024

Volltextzugriff (PDF)

The (E, Z) Isomerization of C-methoxycarbonyl-N-aryl Chlorohydrazones

Chemistry an international journal, 2022-12, Vol.4 (4), p.1624-1653

2022

Volltextzugriff (PDF)

Solubility of Metal Atoms in Helium Droplets: Exploring the Effect of the Well Depth Using the Coinage Metals Cu and Ag

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-06, Vol.115 (25), p.7141-7152

2011

Volltextzugriff (PDF)

Dynamics of photoexcited Ba+ cations in 4He nanodroplets

The Journal of chemical physics, 2016-03, Vol.144 (9)

2016

Volltextzugriff (PDF)

Magnetic Moments and Electron Transport through Chromium-Based Antiferromagnetic Nanojunctions

Materials, 2018-10, Vol.11 (10), p.2030

2018

Volltextzugriff (PDF)

Communication: nucleation of quantized vortex rings in 4He nanodroplets

The Journal of chemical physics, 2014-04, Vol.140 (13), p.131101-131101

2014

Volltextzugriff (PDF)

A Theoretical Study on the Rotational Motion and Interactions in the Disordered Phase of MBH4 (M = Li, Na, K, Rb, Cs)

Journal of physical chemistry. C, 2013-02, Vol.117 (5), p.2308-2316

2013

Volltextzugriff (PDF)

Organic Spintronics: A Theoretical Investigation of a Graphene-Porphyrin Based Nanodevice

Magnetochemistry, 2020-06, Vol.6 (2), p.27

2020

Volltextzugriff (PDF)

Fundamental Properties and Nature of CH··O Interactions in Crystals on the Basis of Experimental and Theoretical Charge Densities. The Case of 3,4-Bis(dimethylamino)-3-cyclobutene-1,2-dione (DMACB) Crystal

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2002-03, Vol.106 (11), p.2707-2720

2002

Volltextzugriff (PDF)

Ground state potential energy surfaces and bound states of M - He dimers ( M = Cu , Ag , Au ) : A theoretical investigation

The Journal of chemical physics, 2008-11, Vol.129 (20), p.204307-204307-12

2008

Volltextzugriff (PDF)

Mapping the complete bonding network in KBH4 using the combined power of powder diffraction and maximum entropy method

Computational and theoretical chemistry, 2015-02, Vol.1053, p.245-253

2015

Volltextzugriff (PDF)

Electronic Structure and Magnetic Coupling of Pure and Mg-Doped KCuF3

Advances in condensed matter physics, 2018-01, Vol.2018 (2018), p.1-10

2018

Volltextzugriff (PDF)

Unraveling the Degradation Mechanism of FIrpic-Based Blue OLEDs: I. A Theoretical Investigation

Chemistry of materials, 2019-04, Vol.31 (7), p.2269-2276

2019

Volltextzugriff (PDF)

Unraveling the Degradation Mechanism in FIrpic-Based Blue OLEDs: II. Trap and Detect Molecules at the Interfaces

Chemistry of materials, 2019-04, Vol.31 (7), p.2277-2285

2019

Volltextzugriff (PDF)

Exciplexes with Ionic Dopants: Stability, Structure, and Experimental Relevance of M + ( 2 P) 4 He n (M = Sr, Ba)

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-08, Vol.118 (33), p.6473-6483

2014

Volltextzugriff (PDF)

Unveiling the acetone sensing mechanism by WO3 chemiresistors through a joint theory-experiment approach

Electrochimica acta, 2021-03, Vol.371, p.137611, Article 137611

2021

Volltextzugriff (PDF)

A cascade mechanism for a simple reaction: The gas-phase methylation of phenol with methanol

Journal of catalysis, 2019-02, Vol.370, p.447-460

2019

Volltextzugriff (PDF)

Ab Initio Many-Body Perturbation Theory Calculations of the Electronic and Optical Properties of Cyclometalated Ir(III) Complexes

Journal of chemical theory and computation, 2020-02, Vol.16 (2), p.1188-1199

2020

Volltextzugriff (PDF)

Ammonium Ferrate‐Catalyzed Cycloaddition of CO 2 to Aziridines for the Synthesis of 1,3‐Oxazolidin‐2‐ones

European journal of organic chemistry, 2022-10, Vol.2022 (40)

2022

Volltextzugriff (PDF)

New Insight into the Electronic and Magnetic Properties of Sub-Stoichiometric WO[sub.3]: A Theoretical Perspective

Crystals (Basel), 2024-04, Vol.14 (4)

2024

Volltextzugriff (PDF)

The electronic structure of nitrilimine: absence of the carbenic form

Chemical communications (Cambridge, England), 2006-01 (9), p.1030-1032

2006

Volltextzugriff (PDF)

Ammonium Ferrate‐Catalyzed Cycloaddition of CO2 to Aziridines for the Synthesis of 1,3‐Oxazolidin‐2‐ones

European journal of organic chemistry, 2022-10, Vol.2022 (40), p.n/a

2022

Volltextzugriff (PDF)

Unveiling the acetone sensing mechanism by WO 3 chemiresistors through a joint theory-experiment approach

Electrochimica acta, 2021-03, Vol.371, p.137611, Article 137611

2021

Volltextzugriff (PDF)

1 – 25 von 57

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(53)
Mit Volltextzugriff
(55)

Publikationsform

Artikel
(57)

Sprache

Englisch
(56)
Japanisch
(8)

Erscheinungsjahr

n.n

Thema

Science & Technology
(29)
Physical Sciences
(28)
Chemistry
(25)
Chemistry, Physical
(17)
Physics
(15)
Technology
(11)
Materials Science
(9)
Materials Science, Multidisciplinary
(9)
Physics, Atomic, Molecular & Chemical
(8)
Density Functional Theory
(7)
Chemistry, Multidisciplinary
(5)
Helium
(5)
Physical And Theoretical Chemistry
(5)
Time Dependence
(5)
Electronic Structure
(4)
Graphene
(4)
Room Temperature
(4)
Carbon
(3)
Cations
(3)
Density Functional Calculations
(3)

15 weitere anzeigen...

Weniger anzeigen...

Menü

Weitere Dienste

Einstellungen

Electronic structure of spin-singlet and spin-triplet atomic carbon upon interaction with helium. A theoretical investigation

Thermodynamic Stability and Electronic Properties of Graphene Nanoflakes

New Insight into the Electronic and Magnetic Properties of Sub-Stoichiometric WO3: A Theoretical Perspective

The (E, Z) Isomerization of C-methoxycarbonyl-N-aryl Chlorohydrazones

Solubility of Metal Atoms in Helium Droplets: Exploring the Effect of the Well Depth Using the Coinage Metals Cu and Ag

Dynamics of photoexcited Ba+ cations in 4He nanodroplets

Magnetic Moments and Electron Transport through Chromium-Based Antiferromagnetic Nanojunctions

Communication: nucleation of quantized vortex rings in 4He nanodroplets

A Theoretical Study on the Rotational Motion and Interactions in the Disordered Phase of MBH4 (M = Li, Na, K, Rb, Cs)

Organic Spintronics: A Theoretical Investigation of a Graphene-Porphyrin Based Nanodevice

Fundamental Properties and Nature of CH··O Interactions in Crystals on the Basis of Experimental and Theoretical Charge Densities. The Case of 3,4-Bis(dimethylamino)-3-cyclobutene-1,2-dione (DMACB) Crystal

Ground state potential energy surfaces and bound states of M - He dimers ( M = Cu , Ag , Au ) : A theoretical investigation

Mapping the complete bonding network in KBH4 using the combined power of powder diffraction and maximum entropy method

Electronic Structure and Magnetic Coupling of Pure and Mg-Doped KCuF3

Unraveling the Degradation Mechanism of FIrpic-Based Blue OLEDs: I. A Theoretical Investigation

Unraveling the Degradation Mechanism in FIrpic-Based Blue OLEDs: II. Trap and Detect Molecules at the Interfaces

Exciplexes with Ionic Dopants: Stability, Structure, and Experimental Relevance of M + ( 2 P) 4 He n (M = Sr, Ba)

Unveiling the acetone sensing mechanism by WO3 chemiresistors through a joint theory-experiment approach

A cascade mechanism for a simple reaction: The gas-phase methylation of phenol with methanol

Ab Initio Many-Body Perturbation Theory Calculations of the Electronic and Optical Properties of Cyclometalated Ir(III) Complexes

Ammonium Ferrate‐Catalyzed Cycloaddition of CO 2 to Aziridines for the Synthesis of 1,3‐Oxazolidin‐2‐ones

New Insight into the Electronic and Magnetic Properties of Sub-Stoichiometric WO[sub.3]: A Theoretical Perspective

The electronic structure of nitrilimine: absence of the carbenic form

Ammonium Ferrate‐Catalyzed Cycloaddition of CO2 to Aziridines for the Synthesis of 1,3‐Oxazolidin‐2‐ones

Unveiling the acetone sensing mechanism by WO 3 chemiresistors through a joint theory-experiment approach

Suchergebnisse filtern