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Keyword [bond dissociation energies]
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1. Quantum Chemical Studies On Bond Dissociation Energies And Hydrogen Bonding Application To Organocatalysis
2. Applications Of Quantum Chemistry Methods In The Calculation Of Physical,Chemical,Biological Properties Of Compounds
3. Accurate Calculations Of Physico-Chemical Properties Of Compounds By The Combination Of DFT And Statistical Correction Methods
4. Polydifluoroaminophenol Compounds And Polynitraminehexaazaadamantane Compounds Were Researched As High Energy Density Compounds
5. Study On Thermal Hazards And Decomposition Mechanisms Of Three Hydroxylamine Compounds
6. Theoretic Studies Of The Structures And Properties Of Energetic High-nitrogen Compounds
7. Improving The Accuracy Of Density Functional Theory Calculation For Homolysis Bond Dissociation Energies Of Y-NO Bond: Neural Network And Support Vector Machine Methods
8. Bond Dissociation Energies In Room-Temperature Ionic Liquids
9. Cage Compounds And Three-membered Ring Compounds Are Studied As High Energy Density Materials
10. Purine Compounds Are Studied As High Energy Density Materials
11. Computational thermodynamic studies of alkali and alkaline earth compounds, olefin metathesis catalysts, and borane -- azoles for chemical hydrogen storage
12. Structure, heats of formation, and bond dissociation energies of group IIIA-group IVA-group VA molecules for chemical hydrogen storage systems
13. Theoretical studies of selenium-dependent reaction mechanisms
14. Development of mass spectrometric methods for the analysis of components and complex interactions in biological systems
15. Bond dissociation energies of small biomolecules from quantum mechanical and Monte Carlo calculations
16. Determination of bond dissociation energies using Fourier transform ion cyclotron resonance (FT-ICR) mass spectrometry
17. Experimental and theoretical studies of binding interactions in divalent transition metal cation-N-donor ligand complexes: Structures, sequential bond dissociation energies, mechanisms and energetics of collision-induced dissociation
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