| /dports/science/py-pyscf/pyscf-2.0.1/examples/pbc/ |
| H A D | 31-low_dimensional_pbc.py | 52 mf = pbchf.RHF(cell) variable
56 mf = pbchf.RHF(cell) variable
63 mf = pbchf.RHF(cell) variable
71 mf = scf.RHF(mol) variable
93 mf = pbchf.KRHF(cell) variable
98 mf = pbchf.KRHF(cell).density_fit(auxbasis='weigend') variable
102 mf = pbchf.KRHF(cell).mix_density_fit(auxbasis='weigend') variable
107 mf = scf.RHF(mol) variable
130 mf = pbchf.KRHF(cell.copy()) variable
134 mf = pbchf.KRHF(cell) variable
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| H A D | 11-gamma_point_all_electron_scf.py | 33 mf = scf.RHF(cell).density_fit() variable
37 mf = scf.RHF(cell).mix_density_fit() variable
47 mf = scf.RHF(cell).density_fit(auxbasis=auxbasis) variable
54 mf = dft.RKS(cell).density_fit(auxbasis='weigend') variable
58 mf = mf.newton() variable
66 mf = dft.RKS(cell).density_fit(auxbasis='weigend') variable
72 mf = dft.RKS(cell).density_fit() variable
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/scf/ |
| H A D | 23-decorate_scf.py | 46 mf = scf.density_fit(scf.sfx2c1e(scf.RHF(mol))) variable
47 mf = scf.RHF(mol).x2c().density_fit() # Stream style variable
55 mf = scf.sfx2c1e(scf.density_fit(scf.RHF(mol))) variable
56 mf = scf.RHF(mol).density_fit().x2c() # Stream style variable
75 mf = scf.newton(scf.RHF(mol)) variable
76 mf = scf.RHF(mol).newton() # Stream style variable
85 mf = scf.density_fit(scf.newton(scf.RHF(mol))) variable
86 mf = scf.RHF(mol).newton().density_fit() variable
95 mf = scf.newton(scf.density_fit(scf.RHF(mol))) variable
96 mf = scf.RHF(mol).density_fit().newton() variable
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| H A D | 15-initial_guess.py | 26 mf = scf.RHF(mol0).run() variable
43 mf = scf.RHF(mol) variable
55 mf = scf.RHF(mol) variable
63 mf = scf.RHF(mol) variable
71 mf = scf.RHF(mol) variable
78 mf = scf.RHF(mol) variable
86 mf = mol.RKS().set(xc='b3lyp') variable
96 mf = scf.RHF(mol) variable
106 mf = scf.RHF(mol) variable
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| H A D | 54-fractional_occupancy.py | 18 mf = scf.RHF(mol) variable
20 mf = scf.addons.frac_occ(mf) variable
28 mf = scf.rhf.RHF(mol) variable
30 mf = scf.addons.frac_occ(mf) variable
38 mf = scf.rohf.ROHF(mol) variable
40 mf = scf.addons.frac_occ(mf) variable
47 mf = scf.UHF(mol) variable
49 mf = scf.addons.frac_occ(mf) variable
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| H A D | 22-newton.py | 26 mf = scf.RHF(mol) variable
32 mf = scf.RHF(mol).newton() variable
36 mf = scf.UKS(mol).newton() # Using stream style variable
52 mf = scf.UKS(mol) variable
54 mf = mf.newton() variable
58 mf = scf.UKS(mol) variable
59 mf = mf.newton() variable
74 mf = scf.RHF(mol).newton() variable
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| H A D | 14-restart.py | 34 mf = scf.RHF(mol) variable
41 mf = scf.RHF(mol) variable
48 mf = scf.RHF(mol) variable
54 mf = scf.RHF(mol) variable
63 mf = scf.RHF(mol) variable
72 mf = scf.RHF(mol) variable
78 mf = scf.RHF(mol) variable
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| H A D | 02-rohf_uhf.py | 30 mf = scf.RHF(mol) variable
33 mf = scf.ROHF(mol) variable
36 mf = scf.UHF(mol) variable
54 mf = scf.RHF(mol) variable
60 mf = scf.ROHF(mol) variable
63 mf = scf.UHF(mol) variable
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/dft/ |
| H A D | 23-decorate_scf.py | 46 mf = scf.density_fit(scf.sfx2c1e(scf.RHF(mol))) variable
47 mf = scf.RHF(mol).x2c().density_fit() # Stream style variable
55 mf = scf.sfx2c1e(scf.density_fit(scf.RHF(mol))) variable
56 mf = scf.RHF(mol).density_fit().x2c() # Stream style variable
75 mf = scf.newton(scf.RHF(mol)) variable
76 mf = scf.RHF(mol).newton() # Stream style variable
85 mf = scf.density_fit(scf.newton(scf.RHF(mol))) variable
86 mf = scf.RHF(mol).newton().density_fit() variable
95 mf = scf.newton(scf.density_fit(scf.RHF(mol))) variable
96 mf = scf.RHF(mol).density_fit().newton() variable
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| H A D | 22-newton.py | 26 mf = scf.RHF(mol) variable
32 mf = scf.RHF(mol).newton() variable
36 mf = scf.UKS(mol).newton() # Using stream style variable
52 mf = scf.UKS(mol) variable
54 mf = mf.newton() variable
58 mf = scf.UKS(mol) variable
59 mf = mf.newton() variable
74 mf = scf.RHF(mol).newton() variable
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| /dports/science/py-pyscf/pyscf-2.0.1/pyscf/scf/ |
| H A D | stability_slow.py | 32 def rhf_stability(mf, internal=True, external=False, verbose=None): argument
38 def uhf_stability(mf, internal=True, external=False, verbose=None): argument
44 def rhf_internal(mf, verbose=None): argument
75 def rhf_external(mf, verbose=None): argument
118 def uhf_internal(mf, verbose=None): argument
165 def uhf_external(mf, verbose=None): argument
234 mf = scf.RHF(mol).run() variable
237 mf = scf.UHF(mol).run() variable
241 mf = scf.UHF(mol).run() variable
249 mf = scf.RHF(mol).run() variable
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/qmmm/ |
| H A D | 11-soscf.py | 34 mf = scf.RHF(mol).x2c() variable
35 mf = qmmm.mm_charge(mf, coords, charges).run() variable
42 mf = scf.RHF(mol) variable
43 mf = qmmm.mm_charge(mf, coords, charges) variable
44 mf = mf.x2c().run() variable
48 mf = scf.RHF(mol) variable
49 mf = mf.x2c().run() variable
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| H A D | 10-x2c.py | 35 mf = scf.RHF(mol).x2c() variable
36 mf = qmmm.mm_charge(mf, coords, charges).run() variable
44 mf = scf.RHF(mol) variable
45 mf = qmmm.mm_charge(mf, coords, charges) variable
46 mf = mf.x2c().run() variable
51 mf = scf.RHF(mol) variable
52 mf = mf.x2c().run() variable
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| /dports/devel/ecgi/ecgi-0.6.3/src/ |
| H A D | memfile.c | 33 void mfclose(MFILE *mf) in mfclose()
64 int mftell(MFILE *mf) in mftell()
69 int mfeof(MFILE *mf) in mfeof()
111 int mfgetc(MFILE *mf) in mfgetc()
125 int mfputc(unsigned char c, MFILE *mf) in mfputc()
168 int mfMFileToFile(MFILE *mf, FILE *f) in mfMFileToFile()
178 int mfFileToMFile(FILE *f, MFILE *mf) in mfFileToMFile()
214 const char *mfGetData(MFILE *mf) in mfGetData()
226 int mfSetLength(MFILE *mf, int length) in mfSetLength()
236 int mfGetLength(MFILE *mf) in mfGetLength()
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| /dports/science/cdk/cdk-cdk-2.3/base/test-interfaces/src/test/java/org/openscience/cdk/interfaces/ |
| H A D | AbstractMolecularFormulaTest.java | 54 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotopeCount0() local
67 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotopeCount() local
85 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testAddIsotope_IIsotope() local
103 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotopeCount_IIsotope() local
129 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotopeCount_IIsotope2() local
153 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testAddIsotope_IIsotope_int() local
179 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotope_Number_Clone() local
209 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testGetIsotopeCount_IIsotope_Occurr() local
250 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testMolecularFormula_NullCharge() local
264 IMolecularFormula mf = getBuilder().newInstance(IMolecularFormula.class); in testIsotopes() local
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/df/ |
| H A D | 01-auxbasis.py | 21 mf = scf.RHF(mol).density_fit() variable
32 mf = scf.RHF(mol).density_fit(auxbasis=auxbasis) variable
40 mf = scf.RHF(mol).density_fit(auxbasis='weigend') variable
47 mf = scf.RHF(mol).density_fit() variable
54 mf = scf.RHF(mol).density_fit() variable
64 mf = scf.RHF(mol).density_fit() variable
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| /dports/java/openjdk13/jdk13u-jdk-13.0.10-1-1/test/jdk/java/util/jar/Attributes/ |
| H A D | NullAndEmptyKeysAndValues.java | 81 Manifest mf = new Manifest(); in testMainAttributesHeaderNameNull() local
94 Manifest mf = new Manifest(); in testMainAttributesHeaderNameEmpty() local
102 Manifest mf = new Manifest(); in testMainAttributesHeaderValueNull() local
116 Manifest mf = new Manifest(); in testMainAttributesHeaderValueEmpty() local
130 Manifest mf = new Manifest(); in testSectionNameNull() local
139 Manifest mf = new Manifest(); in testSectionNameEmpty() local
148 Manifest mf = new Manifest(); in testNamedSectionHeaderNameNull() local
158 Manifest mf = new Manifest(); in testNamedSectionHeaderNameEmpty() local
168 Manifest mf = new Manifest(); in testNamedSectionHeaderValueNull() local
180 Manifest mf = new Manifest(); in testNamedSectionHeaderValueEmpty() local
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| /dports/java/openjdk15/jdk15u-jdk-15.0.6-1-1/test/jdk/java/util/jar/Attributes/ |
| H A D | NullAndEmptyKeysAndValues.java | 81 Manifest mf = new Manifest(); in testMainAttributesHeaderNameNull() local
94 Manifest mf = new Manifest(); in testMainAttributesHeaderNameEmpty() local
102 Manifest mf = new Manifest(); in testMainAttributesHeaderValueNull() local
116 Manifest mf = new Manifest(); in testMainAttributesHeaderValueEmpty() local
130 Manifest mf = new Manifest(); in testSectionNameNull() local
139 Manifest mf = new Manifest(); in testSectionNameEmpty() local
148 Manifest mf = new Manifest(); in testNamedSectionHeaderNameNull() local
158 Manifest mf = new Manifest(); in testNamedSectionHeaderNameEmpty() local
168 Manifest mf = new Manifest(); in testNamedSectionHeaderValueNull() local
180 Manifest mf = new Manifest(); in testNamedSectionHeaderValueEmpty() local
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| /dports/java/openjdk16/jdk16u-jdk-16.0.2-7-1/test/jdk/java/util/jar/Attributes/ |
| H A D | NullAndEmptyKeysAndValues.java | 81 Manifest mf = new Manifest(); in testMainAttributesHeaderNameNull() local
94 Manifest mf = new Manifest(); in testMainAttributesHeaderNameEmpty() local
102 Manifest mf = new Manifest(); in testMainAttributesHeaderValueNull() local
116 Manifest mf = new Manifest(); in testMainAttributesHeaderValueEmpty() local
130 Manifest mf = new Manifest(); in testSectionNameNull() local
139 Manifest mf = new Manifest(); in testSectionNameEmpty() local
148 Manifest mf = new Manifest(); in testNamedSectionHeaderNameNull() local
158 Manifest mf = new Manifest(); in testNamedSectionHeaderNameEmpty() local
168 Manifest mf = new Manifest(); in testNamedSectionHeaderValueNull() local
180 Manifest mf = new Manifest(); in testNamedSectionHeaderValueEmpty() local
[all …]
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| /dports/java/openjdk14/jdk14u-jdk-14.0.2-12-1/test/jdk/java/util/jar/Attributes/ |
| H A D | NullAndEmptyKeysAndValues.java | 81 Manifest mf = new Manifest(); in testMainAttributesHeaderNameNull() local
94 Manifest mf = new Manifest(); in testMainAttributesHeaderNameEmpty() local
102 Manifest mf = new Manifest(); in testMainAttributesHeaderValueNull() local
116 Manifest mf = new Manifest(); in testMainAttributesHeaderValueEmpty() local
130 Manifest mf = new Manifest(); in testSectionNameNull() local
139 Manifest mf = new Manifest(); in testSectionNameEmpty() local
148 Manifest mf = new Manifest(); in testNamedSectionHeaderNameNull() local
158 Manifest mf = new Manifest(); in testNamedSectionHeaderNameEmpty() local
168 Manifest mf = new Manifest(); in testNamedSectionHeaderValueNull() local
180 Manifest mf = new Manifest(); in testNamedSectionHeaderValueEmpty() local
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| /dports/java/openjdk17/jdk17u-jdk-17.0.1-12-1/test/jdk/java/util/jar/Attributes/ |
| H A D | NullAndEmptyKeysAndValues.java | 81 Manifest mf = new Manifest(); in testMainAttributesHeaderNameNull() local
94 Manifest mf = new Manifest(); in testMainAttributesHeaderNameEmpty() local
102 Manifest mf = new Manifest(); in testMainAttributesHeaderValueNull() local
116 Manifest mf = new Manifest(); in testMainAttributesHeaderValueEmpty() local
130 Manifest mf = new Manifest(); in testSectionNameNull() local
139 Manifest mf = new Manifest(); in testSectionNameEmpty() local
148 Manifest mf = new Manifest(); in testNamedSectionHeaderNameNull() local
158 Manifest mf = new Manifest(); in testNamedSectionHeaderNameEmpty() local
168 Manifest mf = new Manifest(); in testNamedSectionHeaderValueNull() local
180 Manifest mf = new Manifest(); in testNamedSectionHeaderValueEmpty() local
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| /dports/www/p5-HTML5-DOM/HTML5-DOM-1.25/third_party/modest/source/myfont/ |
| H A D | myfont.c | 38 mystatus_t myfont_init(myfont_font_t *mf) in myfont_init()
60 void myfont_clean(myfont_font_t *mf) in myfont_clean()
69 myfont_font_t * myfont_destroy(myfont_font_t *mf, bool self_destroy) in myfont_destroy()
84 void * myfont_malloc(myfont_font_t* mf, size_t size) in myfont_malloc()
89 void * myfont_calloc(myfont_font_t* mf, size_t count, size_t size) in myfont_calloc()
97 void myfont_free(myfont_font_t *mf, void* data) in myfont_free()
283 mystatus_t myfont_check_required_tables(myfont_font_t *mf) in myfont_check_required_tables()
300 float myfont_metrics_baseline(myfont_font_t *mf, float font_size) in myfont_metrics_baseline()
305 float myfont_metrics_ascender(myfont_font_t *mf, float font_size) in myfont_metrics_ascender()
315 float myfont_metrics_line_gap(myfont_font_t *mf, float font_size) in myfont_metrics_line_gap()
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| /dports/mail/cyrus-imapd30/cyrus-imapd-3.0.16/lib/ |
| H A D | mappedfile.c | 125 struct mappedfile *mf; in mappedfile_open() local
181 struct mappedfile *mf = *mfp; in mappedfile_close() local
202 EXPORTED int mappedfile_readlock(struct mappedfile *mf) in mappedfile_readlock()
249 EXPORTED int mappedfile_writelock(struct mappedfile *mf) in mappedfile_writelock()
275 EXPORTED int mappedfile_unlock(struct mappedfile *mf) in mappedfile_unlock()
297 EXPORTED int mappedfile_commit(struct mappedfile *mf) in mappedfile_commit()
325 EXPORTED ssize_t mappedfile_pwrite(struct mappedfile *mf, in mappedfile_pwrite()
364 EXPORTED ssize_t mappedfile_pwritebuf(struct mappedfile *mf, in mappedfile_pwritebuf()
371 EXPORTED ssize_t mappedfile_pwritev(struct mappedfile *mf, in mappedfile_pwritev()
475 EXPORTED int mappedfile_islocked(const struct mappedfile *mf) in mappedfile_islocked()
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| /dports/biology/vt/vt-0.57721/lib/htslib/cram/ |
| H A D | mFILE.c | 238 mFILE *mf; in mfcreate_from() local
256 mFILE *mf; in mfreopen() local
348 int mfclose(mFILE *mf) { in mfclose()
376 int mfdetach(mFILE *mf) { in mfdetach()
395 int mfdestroy(mFILE *mf) { in mfdestroy()
458 long mftell(mFILE *mf) { in mftell()
462 void mrewind(mFILE *mf) { in mrewind()
481 int mfeof(mFILE *mf) { in mfeof()
544 int mfgetc(mFILE *mf) { in mfgetc()
594 int mfflush(mFILE *mf) { in mfflush()
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| /dports/biology/freebayes/freebayes-1.3.5/contrib/htslib/cram/ |
| H A D | mFILE.c | 247 mFILE *mf; in mfcreate_from() local
265 mFILE *mf; in mfreopen() local
361 int mfclose(mFILE *mf) { in mfclose()
389 int mfdetach(mFILE *mf) { in mfdetach()
408 int mfdestroy(mFILE *mf) { in mfdestroy()
471 long mftell(mFILE *mf) { in mftell()
475 void mrewind(mFILE *mf) { in mrewind()
494 int mfeof(mFILE *mf) { in mfeof()
557 int mfgetc(mFILE *mf) { in mfgetc()
607 int mfflush(mFILE *mf) { in mfflush()
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