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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/diradicaloids_test_set/ABO-complete/IRC L-TS-ABOHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xd; ircDEF2SVP-584.044282399; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/diradicaloids_test_set/ABO-complete/IRC K-TS-ABOHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xd; ircDEF2SVP-544.865373125; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/diradicaloids_test_set/ABO-complete/SP L-TS-ABOHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-584.631946; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS B-TS-cyclopropane-D1-fo-SP-methylHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-39.8347371; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS B-TS-cyclopropane-D1-fo-SP-subHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-117.8708543; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS B-TS-cyclopropane-D1-fo-SPHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-157.7013502; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS A-TS-ethane-D1-fo-SP-subHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-79.7703502; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS C-TS-cyclobutane-fo-SP-methylHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-39.8335462; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS D-TS-BCB-D1-fo-SP-methylHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-39.8367464; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-DIAS C-TS-cyclobutane-fo-SP-subHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-157.1755179; Eh
Results 401751-401760 of 402241 (Search time: 0.206 seconds).