UB Paderborn / Katalog / Suche / in CDI

1 – 25 von 81

Sortiert nach

A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis

The Journal of chemical physics, 2012-01, Vol.136 (1), p.014108-014108-13

2012

Link zum Volltext

Verfügbarkeit prüfen

Interoperable workflows by exchanging grid-based data between quantum-chemical program packages

The Journal of chemical physics, 2024-04, Vol.160 (16)

2024

Link zum Volltext

Verfügbarkeit prüfen

Strong enhancement of parity violation effects in chiral uranium compounds

Physical chemistry chemical physics : PCCP, 2014-08, Vol.16 (32), p.17043-17051

2014

Link zum Volltext

Verfügbarkeit prüfen

Topological data analysis of vortices in the magnetically-induced current density in LiH molecule

Physical chemistry chemical physics : PCCP, 2023-02, Vol.25 (8), p.5942-5947

2023

Link zum Volltext

Verfügbarkeit prüfen

The DIRAC code for relativistic molecular calculations

The Journal of chemical physics, 2020-05, Vol.152 (20), p.204104-204104

2020

Link zum Volltext

Verfügbarkeit prüfen

A comparison of an antibacterial sandwich dressing vs dressing containing silver

Wound repair and regeneration, 2015-07, Vol.23 (4), p.525-530

2015

Link zum Volltext

Verfügbarkeit prüfen

Spectrophotometric determination of dopamine in microliter scale using microfluidic system based on polymeric technology

Analytica chimica acta, 2005-05, Vol.540 (1), p.153-157

2005

Link zum Volltext

Verfügbarkeit prüfen

Bilateral preventive mastectomy as a preventive method of breast cancer in the opinion of women

Quality in Sport, 2023-06, Vol.14 (1), p.65-79

2023

Link zum Volltext

Verfügbarkeit prüfen

Erratum: “A simple scheme for magnetic balance in four-component relativistic Kohn–Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis” [J. Chem. Phys. 136, 014108 (2012)]

The Journal of chemical physics, 2012-06, Vol.136 (23)

2012

Link zum Volltext

Verfügbarkeit prüfen

A Topological Data Analysis perspective on noncovalent interactions in relativistic calculations

International journal of quantum chemistry, 2020-04, Vol.120 (8), p.n/a

2020

Link zum Volltext

Verfügbarkeit prüfen

Relativistic frozen density embedding calculations of solvent effects on the nuclear magnetic resonance shielding constants of transition metal nuclei

International journal of quantum chemistry, 2021-11, Vol.121 (22), p.n/a

2021

Link zum Volltext

Verfügbarkeit prüfen

Investigating solvent effects on the magnetic properties of molybdate ions (MoO42−) with relativistic embedding

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

2020

Link zum Volltext

Verfügbarkeit prüfen

4-Component relativistic magnetically induced current density using London atomic orbitals

Physical chemistry chemical physics : PCCP, 2011-12, Vol.13 (46), p.2682-2689

2011

Link zum Volltext

Verfügbarkeit prüfen

NMR shielding constants in group 15 trifluorides

Physical chemistry chemical physics : PCCP, 2018, Vol.2 (35), p.2325-2333

2018

Link zum Volltext

Verfügbarkeit prüfen

NMR shielding constants in SeH 2 and TeH 2

Molecular physics, 2013-07, Vol.111 (9-11), p.1355-1363

2013

Link zum Volltext

Verfügbarkeit prüfen

NMR shielding constants in SeH2 and TeH2

Molecular physics, 2013-07, Vol.111 (9-11), p.1355-1363

2013

Link zum Volltext

Verfügbarkeit prüfen

Cover Image, Volume 120, Issue 21

International journal of quantum chemistry, 2020-11, Vol.120 (21)

2020

Link zum Volltext

Verfügbarkeit prüfen

A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis

The Journal of chemical physics, 2012-06, Vol.136 (1), p.014108 (1-13

2012

Link zum Volltext

Verfügbarkeit prüfen

A Topological Data Analysis Perspective on Non-Covalent Interactions in Relativistic Calculations

International journal of quantum chemistry, 2019-12, Vol.e26133

2019

Link zum Volltext

Verfügbarkeit prüfen

The importance of antiangiogenic effect in multiple myeloma treatment

Advances in clinical and experimental medicine : official organ Wroclaw Medical University, 2018-02, Vol.27 (2), p.291-297

2018

Link zum Volltext

Verfügbarkeit prüfen

Effects of Intermittent Pneumatic Compression on Reduction of Postoperative Lower Extremity Edema and Normalization of Foot Microcirculation Flow in Patients Undergoing Arterial Revascularization

Medical science monitor, 2015-12, Vol.21, p.3986-3992

2015

Link zum Volltext

Verfügbarkeit prüfen

Correction: Strong enhancement of parity violation effects in chiral uranium compounds

Physical chemistry chemical physics : PCCP, 2014-11, Vol.16 (46), p.2565-2565

2014

Link zum Volltext

Verfügbarkeit prüfen

Theoretical investigation on the linear and nonlinear susceptibilities of urea crystal

The Journal of chemical physics, 2008-06, Vol.128 (24), p.244713-244713

2008

Link zum Volltext

Verfügbarkeit prüfen

Ab initio study of NMR shielding constants and spin-rotation constants in N, P and As diatomic molecules

Computational and theoretical chemistry, 2011-09, Vol.970 (1), p.54-60

2011

Link zum Volltext

Verfügbarkeit prüfen

NMR Shielding Constants in PH 3 , Absolute Shielding Scale, and the Nuclear Magnetic Moment of 31 P

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-09, Vol.115 (38), p.10617-10623

2011

Link zum Volltext

Verfügbarkeit prüfen

1 – 25 von 81

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(77)
Mit Volltextzugriff
(78)

Publikationsform

Sprache

Erscheinungsjahr

n.n

Thema

Science & Technology
(49)
Chemistry
(31)
Physical Sciences
(30)
Life Sciences & Biomedicine
(24)
Chemistry, Physical
(20)
Physics
(18)
Physics, Atomic, Molecular & Chemical
(15)
Humans
(12)
Chemical Sciences
(10)
Or Physical Chemistry
(9)
Theoretical And
(9)
Relativistic Effects
(8)
Chemistry, Multidisciplinary
(7)
Nuclear Magnetic Resonance
(7)
Biochemistry & Molecular Biology
(6)
Exact Sciences And Technology
(6)
Female
(6)
Mathematical Analysis
(6)
Technology
(6)
Adult
(5)

15 weitere anzeigen...

Weniger anzeigen...

Menü

Weitere Dienste

Einstellungen

A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis

Interoperable workflows by exchanging grid-based data between quantum-chemical program packages

Strong enhancement of parity violation effects in chiral uranium compounds

Topological data analysis of vortices in the magnetically-induced current density in LiH molecule

The DIRAC code for relativistic molecular calculations

A comparison of an antibacterial sandwich dressing vs dressing containing silver

Spectrophotometric determination of dopamine in microliter scale using microfluidic system based on polymeric technology

Bilateral preventive mastectomy as a preventive method of breast cancer in the opinion of women

Erratum: “A simple scheme for magnetic balance in four-component relativistic Kohn–Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis” [J. Chem. Phys. 136, 014108 (2012)]

A Topological Data Analysis perspective on noncovalent interactions in relativistic calculations

Relativistic frozen density embedding calculations of solvent effects on the nuclear magnetic resonance shielding constants of transition metal nuclei

Investigating solvent effects on the magnetic properties of molybdate ions (MoO42−) with relativistic embedding

4-Component relativistic magnetically induced current density using London atomic orbitals

NMR shielding constants in group 15 trifluorides

NMR shielding constants in SeH 2 and TeH 2

NMR shielding constants in SeH2 and TeH2

Cover Image, Volume 120, Issue 21

A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis

A Topological Data Analysis Perspective on Non-Covalent Interactions in Relativistic Calculations

The importance of antiangiogenic effect in multiple myeloma treatment

Effects of Intermittent Pneumatic Compression on Reduction of Postoperative Lower Extremity Edema and Normalization of Foot Microcirculation Flow in Patients Undergoing Arterial Revascularization

Correction: Strong enhancement of parity violation effects in chiral uranium compounds

Theoretical investigation on the linear and nonlinear susceptibilities of urea crystal

Ab initio study of NMR shielding constants and spin-rotation constants in N, P and As diatomic molecules

NMR Shielding Constants in PH 3 , Absolute Shielding Scale, and the Nuclear Magnetic Moment of 31 P

Suchergebnisse filtern