New answers tagged potential-energy-surface
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What is the branching space of a conical section?
I'm a bit late to the party but if you're interested I can provide some further information. In general the PES(in the Born Oppenheimer approximation) has dimensionality 3N-6, where N is defined to be ...
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Accepted
Gaussian 18: Relaxed scan using Jacobi coordinates expressed using generalized internal coordinates
Based on the GIC page in Gaussian website and your picture, the definition of the coordinates would be:
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Accepted
What is the branching space of a conical section?
A paper called "Potential energy surfaces near intersections" [1] provides the answer.
At the conical intersection, the energies of two potential energy surfaces parameterized by ...
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