Merge pull request #18 from brucefan1983/table_speedup

Table speedup
brucefan1983 · Apr 2, 2023 · 271a685 · 271a685
2 parents 9658801 + ee29a9c
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diff --git a/README.md b/README.md
@@ -12,6 +12,12 @@
   * `src/nep.h`
   * `src/nep.cpp`
 
+* There is an option to use tables to speed up the calculations for the radial functions in NEP. To enable it, one can change line 20 of `src/nep.h`:
+
+```
+// #define USE_TABLE_FOR_RADIAL_FUNCTIONS
+```
+
 * The following folder contains some testing code and results:
   * `test/`