Structural flexibility of DABCO. Ab initio and DFT benchmark study
Author:
Funder
Russian Science Foundation
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference49 articles.
1. Non-Born–Oppenheimer wavepacket dynamics in polyatomic molecules: vibrations at conical intersections in DABCO
2. Systematic theoretical studies of the interaction of 1,4-diazabicyclo [2.2.2]octane (DABCO) with rare gases
3. Unusual Quantum Interference in the S1 State of DABCO and Observation of Intramolecular Vibrational Redistribution
4. Time resolved observation of the solvation dynamics of a Rydberg excited molecule deposited on an argon cluster-I: DABCO☆at short times
5. Recyclable and Reusable Pd(OAc)2/DABCO/PEG-400 System for Suzuki−Miyaura Cross-Coupling Reaction
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1. Heat capacity of flexible MOFs M2(bdc)2(dabco) (M = Co, Ni, Cu, Zn);Microporous and Mesoporous Materials;2022-08
2. A Computational Approach to Nontraditional Intrinsic Luminescence: Vibrationally Resolved Absorption and Fluorescence Spectra of DABCO;The Journal of Physical Chemistry A;2022-02-16
3. Synthesis, molecular structure, and properties of DABCO bromide based ionic liquid combining spectroscopic studies with DFT calculations;Journal of Molecular Structure;2021-06
4. Chirality and Relativistic Effects in Os3(CO)12;Molecules;2021-06-01
5. On the Possibility to Observe Relations Between Quantum Measurements and the Entropy of Phase Transitions in Zn2(BDC)2(DABCO);Foundations of Physics;2021-02
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