Item hits:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
![]() | /template-3/ts1/c5 1_ts1c5_FBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01975780; Eh | ||
![]() | /template-3/ts1/c5 2_ts1c5_FFONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02480976; Eh | ||
![]() | /template-3/ts1/c5 3_ts1c5_FFINA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02384541; Eh | ||
![]() | /template-3/ts1/c5 4_ts1c5_BFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02907417; Eh | ||
![]() | /template-3/ts1/c5 5_ts1c5_BFONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevC.01 | RMN15 | GEN | -3058.01947136; Eh | ||
![]() | /template-3/ts1/c5 6_ts1c5_FBINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01858340; Eh | ||
![]() | /template-3/ts1/c5 7_ts1c5_BBINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02596707; Eh | ||
![]() | /template-3/ts1/c5 8_ts1c5_BBINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | DEF2SVP GEN DEF2TZVPP | -3061.4525494; Eh | ||
![]() | /template-3/ts1/c5 9_ts1c5_FFOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02583593; Eh | ||
![]() | /template-3/ts1/c5 10_ts1c5_BBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN DEF2TZVPP | -3061.4505035; Eh | ||
![]() | /template-3/ts1/c5 11_ts1c5_FBOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02070842; Eh | ||
![]() | /template-3/ts1/c5 12_ts1c5_BFOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevC.01 | RMN15 | GEN | -3058.01847682; Eh | ||
![]() | /template-3/ts1/c5 13_ts1c5_FBIAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02671810; Eh | ||
![]() | /template-3/ts1/c5 14_ts1c5_BBIAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN DEF2TZVPP | -3061.450836; Eh | ||
![]() | /template-3/ts1/c5 15_ts1c5_FFIAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevC.01 | RMN15 | GEN | -3058.03225996; Eh | ||
![]() | /template-3/ts1/c5 16_ts1c5_BBOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN DEF2TZVPP | -3061.4486698; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_BFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02358075; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_BFOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01321453; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_BFONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01430077; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_FBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01519749; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_FFIAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02347851; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_FFOAIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.02078314; Eh | ||
![]() | /template-3/ts1/c6 ts1c6_FFONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01727949; Eh | ||
![]() | /template-3/ts1/c7 ts1c7_BFININ | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01932928; Eh | ||
![]() | /template-3/ts1/c7 ts1c7_BFONIN | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | GEN | -3058.01281051; Eh |
Results 1-25 of 285 (Search time: 0.324 seconds).
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Subject
- 285 C-H activation
- 285 Olefination
- 285 Palladium
Basis
Stoichiometry
Program name
- 285 Gaussian
Calculation type
Institution