Optimize vloc_of_g by skipping negligible analytic terms #6932
+50
−4
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Summary
This commit optimizes the
vloc_of_gfunction invl_pw.cppby introducing a numerical cutoff for the analytic Fourier transform correction and refining dependencies.Key Changes
if (gx2 > 921) { continue; }.exp(-gx2 * 0.25)is less than1e-100whengx2 > 921, skipping this term avoids unnecessary exponential calculations and potential floating-point underflow issues for high-frequency G-vectors.Verification