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physics, atomic, molecular & chemical (11) 11
chemistry, physical (10) 10
excited-states (5) 5
quantum-chemistry (4) 4
biradicaloids (3) 3
chemistry (3) 3
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adiabatische zustandsänderung (2) 2
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Chemical Physics, ISSN 0301-0104, 11/2018, Volume 515, pp. 350 - 359
A five-state multimode non-adiabatic dynamics has been performed on NO by constructing accurate diabatic potential energy surfaces (PESs) in vibronically... 
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 08/2011, Volume 135, Issue 5, pp. 054101 - 054101-17
Journal Article
Chemical Physics, ISSN 0301-0104, 11/2018, Volume 515, p. 350
A five-state multimode non-adiabatic dynamics has been performed on NO.sub.3 by constructing accurate diabatic potential energy surfaces (PESs) in vibronically... 
Force and energy
Journal Article
Molecular Physics, ISSN 0026-8976, 06/2018, Volume 116, Issue 11, pp. 1483 - 1495
Journal Article
The Journal of Physical Chemistry A, ISSN 1089-5639, 11/2008, Volume 112, Issue 46, pp. 11895 - 11902
Journal Article
International Journal of Quantum Chemistry, ISSN 0020-7608, 08/2019, Volume 119, Issue 16, p. n/a
In the present article are analyzed the non‐adiabatic coupling terms (NACT) for two molecular systems, namely H3+ and H3. In contrast to previous occasions in... 
Journal Article
Chemical Physics, ISSN 0301-0104, 11/2018, Volume 515, pp. 350 - 359
[Display omitted] A five-state multimode non-adiabatic dynamics has been performed on NO3 by constructing accurate diabatic potential energy surfaces (PESs) in... 
SCATTERING PROCESSES | SPECTROSCOPY | NITRATE | NONADIABATIC COUPLING TERMS | AB-INITIO | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | CONICAL INTERSECTION | ULTRAVIOLET | MULTIMODE NUCLEAR-DYNAMICS | SYMMETRY-BREAKING | ELECTRONIC-STATE
Journal Article
Chemistry - A European Journal, ISSN 0947-6539, 2016, Volume 22, Issue 34, pp. 12027 - 12033
Journal Article
Chemistry - A European Journal, ISSN 0947-6539, 2016, Volume 22, Issue 34, p. 11877
Journal Article
Dalton Transactions, ISSN 1477-9226, 08/2015, Volume 44, Issue 36, pp. 15779 - 15785
The reaction of a recently synthesized dihydroboron species complexed with bis(phosphinimino)amide, LBH2 (1), (L = [N(Ph2PN-(2,4,6-Me3C6H2))(2)](-)) with 3... 
DIPOLE-MOMENT | BORINIUM | BONDS | SUBSTITUTION STRUCTURE | CHEMISTRY | BORON CATION | SULFUR | MICROWAVE-SPECTRUM | QUADRUPOLE-MOMENT | BORENIUM | CHEMISTRY, INORGANIC & NUCLEAR | Boron Compounds - chemistry | Models, Molecular | Selenium - chemistry | Sulfhydryl Compounds - chemistry | Molecular Structure | Boron Compounds - chemical synthesis
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 11/2009, Volume 131, Issue 17, pp. 174109 - 174109-17
Journal Article
Dalton Transactions, ISSN 1477-9226, 09/2015, Volume 44, Issue 36, pp. 15779 - 15785
The reaction of a recently synthesized dihydroboron species complexed with bis(phosphinimino)amide, LBH sub(2) (1), (L = [N(Ph sub(2)PN(2,4,6-Me sub(3)C... 
Diffraction | Equivalence | Refluxing | X-rays | Chemical bonds | Selenium | Terminals | Mass spectrometry
Journal Article
Chemistry – A European Journal, ISSN 0947-6539, 08/2016, Volume 22, Issue 34, pp. 12027 - 12033
Reduction of the cyclodiphosphazane [(S=)ClP(μ‐NtBu)]2 (1) with sodium metal in refluxing toluene proceeds via two different pathways. One is a Wurtz‐type... 
biradicaloids | reduction | macrocycles | phosphazanes | cyclization | Refluxing | Pathways | Sodium | Sodium chloride | Toluene
Journal Article
Chemistry – A European Journal, ISSN 0947-6539, 08/2016, Volume 22, Issue 34, pp. 11873 - 11873
A sulfur‐bridged inorganic macrocycle and a room temperature singlet biradicaloid dianion have been isolated in the Wurtz reduction of a mixture of cis‐ and... 
biradicaloids | reduction | macrocycles | phosphazanes | cyclization | Reduction | Pathways | Sulfur | Assemblies | Temperature effects
Journal Article
Molecular Physics, ISSN 0026-8976, 08/2005, Volume 103, Issue 15-16, pp. 2277 - 2298
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 02/2001, Volume 114, Issue 5, pp. 1981 - 1988
Journal Article
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