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Working on Nuclear ints
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@ -19,7 +19,7 @@ let zero_m ~maxm ~expo_pq_inv ~norm_pq_sq =
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let t = norm_pq_sq *. exp_pq in
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let t = norm_pq_sq *. exp_pq in
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boys_function ~maxm t
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boys_function ~maxm t
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|> Array.mapi (fun m fm ->
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|> Array.mapi (fun m fm ->
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two_over_sq_pi *. (if m mod 2 = 0 then fm else -.fm) *.
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two_over_sq_pi *. fm *.
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(pow exp_pq m) *. (sqrt exp_pq)
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(pow exp_pq m) *. (sqrt exp_pq)
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)
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)
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