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Searched refs:tag_in_lib (Results 1 – 8 of 8) sorted by relevance

/dports/science/nwchem-data/nwchem-7.0.2-release/src/basis/
H A Dbas_input.F354 character*16 tag, tag_in_lib
534 tag_in_lib = tag
539 tag_in_lib = standard
582 if (tag_in_lib .ne. ' ' .and. standard .ne. ' ') then
583 star_in_lib(star_nr_tags) = tag_in_lib
596 call bas_tag_lib(basis, osegment, tag, tag_in_lib, standard,
887 subroutine bas_tag_lib(basis, osegment, tag, tag_in_lib, argument
903 character*16 tag_in_lib !< [Input] tag to lookup in library
951 if (.not. geom_tag_to_element(tag_in_lib, symbol, element, atn))
1169 1000 write(LuOut,*) ' bas_tag_lib: looking for ', tag_in_lib, standard,
H A Dbasis.F1036 character*16 tag_to_add, tag_in_lib local
1228 , int_mb(i_array+junique-1),tag_in_lib))
1231 if (inp_compare(.true.,tag_to_add,tag_in_lib)
1233 & inp_strlen(tag_in_lib))) goto 00012
1277 tag_in_lib = star_in_lib(istar)
1279 & tag_in_lib = tag_to_add
1281 & tag_in_lib, star_bas_typ(istar), star_file(istar),
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/basis/
H A Dbas_input.F355 character*16 tag, tag_in_lib
538 tag_in_lib = tag
543 tag_in_lib = standard
591 if (tag_in_lib .ne. ' ' .and. standard .ne. ' ') then
592 star_in_lib(star_nr_tags) = tag_in_lib
605 call bas_tag_lib(basis, osegment, tag, tag_in_lib, standard,
896 subroutine bas_tag_lib(basis, osegment, tag, tag_in_lib, argument
912 character*16 tag_in_lib !< [Input] tag to lookup in library
963 if (.not. geom_tag_to_element(tag_in_lib, symbol, element, atn))
1190 1000 write(LuOut,*) ' bas_tag_lib: looking for ', tag_in_lib, standard,
H A Dbasis.F1037 character*16 tag_to_add, tag_in_lib
1229 , int_mb(i_array+junique-1),tag_in_lib))
1232 if (inp_compare(.true.,tag_to_add,tag_in_lib)
1234 & inp_strlen(tag_in_lib))) goto 00012
1278 tag_in_lib = star_in_lib(istar)
1280 & tag_in_lib = tag_to_add
1282 & tag_in_lib, star_bas_typ(istar), star_file(istar),
/dports/science/nwchem-data/nwchem-7.0.2-release/doc/user/
H A Dbasis.tex36 <string tag> library [<string tag_in_lib>] \
152 <string tag> library [<string tag_in_lib>] \
213 variable \verb+<tag_in_lib>+ must also be entered on this line, to
H A Decp.tex92 <string tag> library [<string tag_in_lib>] \
237 <string tag> library [<string tag_in_lib>] \
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/doc/user/
H A Dbasis.tex36 <string tag> library [<string tag_in_lib>] \
152 <string tag> library [<string tag_in_lib>] \
213 variable \verb+<tag_in_lib>+ must also be entered on this line, to
H A Decp.tex92 <string tag> library [<string tag_in_lib>] \
237 <string tag> library [<string tag_in_lib>] \