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I deposit a thin film of HTM based carbazole and I measure the PL at lower tempertaure . by fiiting the experimental results with 5 peaks . I notice the dissapering of peak 1 at 300K and peak 3 at 200K. What is the nature of the interaction that can occur at lower temperature of...
Homework Statement:: difference between DFT and TDDFT in Gaussian 09 software?
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Please I want to know what is the difference between DFT and time‐dependent density functional theory TD-DFT and why we use it in the measurement of...
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In my research study, i am focusing the interprete the effect of solvent on opticals propertie of carbazole based hole transporting materials ,In order to dissolve this materials in different Concentration of solvents ; I have been using Toluene , chlorobenzene and...
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Recently, I’ve been trying to calculate the optimization and Uv spectra of organometallic compounds using the Gaussian software .it’s my first time for the computational chemistry and I am inexperienced . When I...