fix a bug of relax_nmax default

WHUweiqingzhou · WHUweiqingzhou · commit 86af7fccd5fb · 2024-11-15T17:46:22.000+08:00
diff --git a/source/module_io/read_input_item_relax.cpp b/source/module_io/read_input_item_relax.cpp
@@ -58,7 +58,7 @@ void ReadInput::item_relax()
             }
             else if (calculation == "relax" || calculation == "cell-relax")
             {
-                if (!para.input.relax_nmax)
+                if (para.input.relax_nmax == 1)
                 {
                     para.input.relax_nmax = 50;
                 }

Original file line number	Diff line number	Diff line change
`@@ -58,7 +58,7 @@ void ReadInput::item_relax()`
`58`	`58`	`}`
`59`	`59`	`else if (calculation == "relax" \|\| calculation == "cell-relax")`
`60`	`60`	`{`
`61`		`- if (!para.input.relax_nmax)`
	`61`	`+ if (para.input.relax_nmax == 1)`
`62`	`62`	`{`
`63`	`63`	`para.input.relax_nmax = 50;`
`64`	`64`	`}`