Distributions of r 1 ⋅r 2 and p 1 ⋅p 2 in atoms
We consider the two-electron position and momentum dot products, α = r1·r2 and β = p1·p2, and present a method for extracting their distributions, A(α) and B(β), from molecular wave functions built on Gaussian basis functions. The characteristics of
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|Source:||Journal of Chemical Theory and Computation (JCTC)|
|01_Hollett_Distributions_of_r_1_⋅r_2__and_2012.pdf||279.53 kB||Adobe PDF||Request a copy|
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