@Isabela_Man2

Isabela Costinela Man

2 Questions 7 Answers 0 Followers

Questions related from Isabela Costinela Man

Dear all, how should I do the setups - in gaussian for two molecules with opposite charges?

Example a protonated pyridine and a deprotonated alpha acetoacetate. Thank you!

02 February 2018 8,667 5 View

How can I find easily the distance between the center of mass of a molecule (larger one and a solid surface)?

ex. Chlorobenzene on rutile TiO2(110) surface.

08 August 2013 2,147 3 View

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