Change comments from van der Waals radii to atom radii

cmsi · Jul 31, 2021 · 390dfe8 · 390dfe8
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commit 390dfe8
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diff --git a/doc/User_manual b/doc/User_manual
@@ -277,7 +277,7 @@
  = .false. Redundant coordinate (default)
  = .true. Cartesian coordinate
 
- fbond specifies the scaling factor of van der Waals radii for 
+ fbond specifies the scaling factor of atom radii for 
  bond detection. (default: 1.20E+0)
 
  2.5 dft keywords

diff --git a/src/module.F90 b/src/module.F90
@@ -184,7 +184,7 @@ module modtype
 ! nopt : Maximum number of geometry optimization cycles
 ! dconv : Threshold for SCF density convergence
 ! optconv : Threshold for geometry optimization convergence
-! fbond : Scaling factor of van der Waals radii for bond detection
+! fbond : Scaling factor of atom radii for bond detection
 ! hfexchange : Factor of Hartree-Fock Exchange in DFT
 ! bqrad : Radii of ghost (Bq) atoms
 ! threshex : Threshold for overlap of two basis functions