cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/input_cp2k_subsys.F

42                                               section_create,&
82       CALL section_create(section, __LOCATION__, "CELL", &
87       CALL section_create(subsection, __LOCATION__, "CELL_REF", &
248       CALL section_create(section, __LOCATION__, name="RNG_INIT", &
277       CALL section_create(section, __LOCATION__, name="subsys", &
366       CALL section_create(section, __LOCATION__, name="print", &
607       CALL section_create(section, __LOCATION__, name="multipoles", &
612       CALL section_create(subsection, __LOCATION__, name="dipoles", &
625       CALL section_create(subsection, __LOCATION__, name="quadrupoles", &
717       CALL section_create(section, __LOCATION__, name="velocity", &
756       CALL section_create(section, __LOCATION__, name="shell_velocity", &
787       CALL section_create(section, __LOCATION__, name="core_velocity", &
817       CALL section_create(section, __LOCATION__, name="potential", &
842       CALL section_create(section, __LOCATION__, name="kg_potential", &
867       CALL section_create(section, __LOCATION__, name="BASIS", &
925       CALL section_create(section, __LOCATION__, name="coord", &
972       CALL section_create(section, __LOCATION__, name="shell_coord", &
1017       CALL section_create(section, __LOCATION__, name="core_coord", &
1064       CALL section_create(section, __LOCATION__, name="KIND", &
1382       CALL section_create(section, __LOCATION__, name="PAO_POTENTIAL", repeats=.TRUE., &
1424       CALL section_create(section, __LOCATION__, name="PAO_DESCRIPTOR", repeats=.TRUE., &
1468       CALL section_create(section, __LOCATION__, &
1489       CALL section_create(subsection, __LOCATION__, name="ALPHA", description="alpha spin", &
1532       CALL section_create(subsection, __LOCATION__, name="BETA", description="beta spin", &
1594       CALL section_create(section, __LOCATION__, name="TOPOLOGY", &
1834       CALL section_create(section, __LOCATION__, TRIM(header), &
1865       CALL section_create(section, __LOCATION__, "CENTER_COORDINATES", &
1902       CALL section_create(section, __LOCATION__, name="MOL_SET", &
1908       CALL section_create(subsection, __LOCATION__, name="MOLECULE", &
1923       CALL section_create(subsection, __LOCATION__, name="MERGE_MOLECULES", &
1928       CALL section_create(subsubsection, __LOCATION__, name="bonds", &
1940       CALL section_create(subsubsection, __LOCATION__, name="angles", &
1952       CALL section_create(subsubsection, __LOCATION__, name="torsions", &
1964       CALL section_create(subsubsection, __LOCATION__, name="impropers", &
1997       CALL section_create(section, __LOCATION__, name="GENERATE", &
2052       CALL section_create(subsection, __LOCATION__, name="BOND", &
2077       CALL section_create(subsection, __LOCATION__, name="ANGLE", &
2102       CALL section_create(subsection, __LOCATION__, name="TORSION", &
2127       CALL section_create(subsection, __LOCATION__, name="IMPROPER", &
2152       CALL section_create(subsection, __LOCATION__, name="ISOLATED_ATOMS", &
2190       CALL section_create(section, __LOCATION__, name="print", &
2286       CALL section_create(section, __LOCATION__, &
2366       CALL section_create(subsection, __LOCATION__, &