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Good day everyone, I have collected few numeric data from Gaussian output, but may I know the error value for Gaussian data? Is that standard or I should calculate it depend on my data?
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Good day everyone, I have a structure and one of the atom is AU. I need to optimize this structure in Gaussian. Which basis set, level of theory and memory would be suitable to run this DFT...
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Good day everyone, I m confused with the reliability of my output file. For my system, I have used using 6-31G+(d) and 6-31G+ basis set and now which out put is more reliable and fits for DFT...
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Hello everyone, I am in-need for a good explanation regarding the molecular energy. I'm curious how the highest negative number could have a stable energy and the less negative number have...
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