fix

deepmodeling · Dec 14, 2021 · 2ec3574 · 2ec3574
1 parent edc4803
commit 2ec3574
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/source/ipi/driver.cc b/source/ipi/driver.cc
@@ -158,7 +158,7 @@ int main(int argc, char * argv[])
       readbuffer_ (&socket, (char *)(cell_h),  9*sizeof(double));
       readbuffer_ (&socket, (char *)(cell_ih), 9*sizeof(double));
       for (int dd = 0; dd < 9; ++dd){
-	dbox[dd] = cell_h[(ii%3)*3+(ii/3)] * cvt_len;
+	dbox[dd] = cell_h[(dd%3)*3+(dd/3)] * cvt_len;
       }
       region.reinitBox (&dbox[0]);