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2009, ISBN 9783527320189, xxiii, 419
The first book dedicated to this new and powerful computational method begins with a comprehensive description of MCTDH and its theoretical background. There... 
MCTDH | Quantum theory | Computational Chemistry & Molecular Modeling
Book
Infection control and hospital epidemiology, ISSN 0899-823X, 10/2008, Volume 29, Issue 10, pp. 986 - 987
Journal Article
Journal of chemical theory and computation, ISSN 1549-9618, 06/2017, Volume 13, Issue 6, pp. 2777 - 2788
Nitrobenzene is the simplest nitroaromatic compound and yet is characterized by a challenging and rich photophysics and photochemistry. In the present... 
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Photodegradation | Nitrobenzene | Deformation mechanisms | Decay | Fluorescence | Ground state | Phosphorescence | Intersections | Photochemistry
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9084, 2019, Volume 21, Issue 20, pp. 10514 - 10522
S 1 /S 0 accessibility strongly influences the triplet quantum yields of nitronaphthalenes. The photophysics of nitroaromatic compounds is characterized by an... 
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology
Journal Article
ISSN 1463-9076, 5/2019, Volume 21, Issue 2, pp. 1514 - 1522
The photophysics of nitroaromatic compounds is characterized by an ultrafast decay into the triplet manifold and by significant triplet quantum yields. The... 
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 2017, Volume 19, Issue 43, pp. 29483 - 29497
A ten singlet state vibronic coupling Hamiltonian was constructed describing the seven internal coordinates of acetylene. A Sigma(+)(g) symmetry-adapted... 
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Adiabatic flow | Excitation | Mathematical analysis | Acetylene
Journal Article
Journal of allergy and clinical immunology, ISSN 0091-6749, 12/2017, Volume 140, Issue 6, pp. 1660 - 1670.e16
Abstract Background Thymus transplantation is a promising strategy for the treatment of athymic complete DiGeorge syndrome (cDGS). Methods Twelve patients with... 
Allergy and Immunology | DiGeorge syndrome | athymia | thymus transplantation | Allergy | Immunology | Life Sciences & Biomedicine | Science & Technology | DiGeorge Syndrome - therapy | Immune Reconstitution | Europe | Humans | Autoimmune Diseases - immunology | Cells, Cultured | Child, Preschool | Infant | Male | Organ Transplantation | Treatment Outcome | Autoimmune Diseases - etiology | Postoperative Complications - immunology | Transplantation, Homologous | DiGeorge Syndrome - immunology | Thymus Gland - transplantation | Female | T-Lymphocytes - immunology | Child | Organ Culture Techniques | Immunological deficiency syndromes | Hemolysis | Thyroiditis | Thrombocytopenia | Antigens | Complications | Septic shock | Antimicrobial agents | Transplantation | Lymphocytes T | T cell receptors | Infections | Patients | Inflammatory diseases | Defects | CD4 antigen | Thymus | T-cell receptor | Thymopoiesis | Biopsy | Lymphocytes | Stem cells | Thymic hypoplasia | Mutation | Neutropenia | Index Medicus | Abridged Index Medicus | HSCT, Hematopoietic stem cell transplantation | TCR, T-cell receptor | mTEC, Medullary thymic epithelial cell | CTLA4, Cytotoxic T lymphocyte–associated antigen 4 | ATG, Antithymocyte globulin | cTEC, Cortical thymic epithelial cell | EpCam, Epithelial cell adhesion molecule | FoxP3, Forkhead box P3 | TEC, Thymic epithelial cell | Treg, Regulatory T | AIRE, Autoimmune regulator | CHARGE, Coloboma, heart defects, atresia choanae, retardation of growth and development, genital abnormalities, ear abnormalities | DGS, DiGeorge syndrome | CMV, Cytomegalovirus | LCL, Lymphoblastoid cell line | TREC, T-cell receptor signal joint excision circle | cDGS, Complete DiGeorge syndrome | SCID, Severe combined immunodeficiency | deafness | CK, Cytokeratin
Journal Article
ISSN 1463-9076, 11/2017, Volume 19, Issue 43, pp. 29483 - 29497
A ten singlet state vibronic coupling Hamiltonian was constructed describing the seven internal coordinates of acetylene. A Σ + g symmetry-adapted polynomial... 
Journal Article
Chemical Society reviews, ISSN 1460-4744, 2018, Volume 47, Issue 2, pp. 309 - 321
..., 47,3 0 9 of photoexcited molecules Helen H. Fielding * and Graham A. Worth * Time-resolved photoelectron spectroscopy measurements combined with quantum chemistry... 
Physical Sciences | Chemistry | Chemistry, Multidisciplinary | Science & Technology | Potential energy | Energy consumption | Electronic structure | Quantum chemistry | Mathematical analysis | Benzene | Fluorescence | Spectroscopic analysis | Photoelectron spectroscopy | Electrons | Chemical Sciences | Physics
Journal Article
Journal of Allergy and Clinical Immunology, The, ISSN 0091-6749, 2014, Volume 133, Issue 6, pp. 1660 - 1666
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 2019, Volume 21, Issue 26, pp. 14429 - 14439
We revisit the seminal work on the control of IBr photodissociation using a strong non-resonant IR pulse, calculating the full 36-state manifold of spin–orbit... 
Journal Article
ISSN 1463-9076, 7/2019, Volume 21, Issue 26, pp. 14429 - 14439
In a seminal work the photodissociation of IBr has been controlled using a strong non-resonant IR pulse [Sussman et al. , Science , 2006, 314 , 274], changing... 
Journal Article
Chemical physics, ISSN 0301-0104, 10/2015, Volume 460, pp. 125 - 134
[Display omitted] •Symmetrised polynomials up to 6th order generated for Abelian and non-Abelian point groups.•Polynomials suitable for Hamiltonians describing... 
Vibronic coupling | Pseudo Jahn–Teller | Symmetry-adapted basis | Acetylene spectrum | Renner–Teller | Singlet excited states | Renner-Teller | Pseudo Jahn-Teller | Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology
Journal Article
International reviews in physical chemistry, ISSN 1366-591X, 07/2015, Volume 34, Issue 2, pp. 269 - 308
Journal Article