Density functional theory
GAMESS US, ORCA and many others - these two I've seen working under windows even in parallel, others - look at
https://en.wikipedia.org/wiki/List_of_quantum_chemistry_and_solid-state_physics_software
visit their homepages for information on windows versions.
I have transmission data of UV spectrophotometer in MS Excel and would like to know how it can be convert into absorption data. Please tell me about this.
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For research
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I am doing research on theoretical computational chemistry.
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In order to show people the beauty of control and enhance enthusiasm for learning control theories, are there any good simple systems or platforms to recommend?
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