| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/Product-Opt D-product | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | wb97xd | DEF2SVP | -195.663999889; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/TS-SP D-TS-SP | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | uwb97xd | DEF2TZVPP | -195.7820516; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set CH3-radical | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | uwb97xd | DEF2SVP | -39.7924989836; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set CH3-radical-SP | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | uwb97xd | DEF2TZVPP | -39.8395904; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/Product-Opt L-product | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | uwb97xd | DEF2SVP | -351.593457493; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/TS-IRC G-TS-IRC | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | irc; uwb97xd | DEF2SVP | -274.211906875; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/TS-IRC F-TS-IRC | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | irc; uwb97xd | DEF2SVP | -274.229145608; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/TS-IRC E-TS-IRC | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | irc; uwb97xd | DEF2SVP | -234.875280754; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/TS-IRC D-TS-IRC | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | irc; uwb97xd | DEF2SVP | -195.643045781; Eh | | | |
 | 23-Jun-2026 | /Gaussian_output_files/Me_radical_test_set/Product-Opt J-product | Houk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil K | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | wb97xd | DEF2SVP | -312.282151646; Eh | | | |
