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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable L-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-351.8112821; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable F-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-274.4463017; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable K-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-312.4959053; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable G-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-274.414793; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable H-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-233.8513089; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/Me_radical_test_set/TS-Stable B-stableHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevC.02Single point Structureuwb97xdDEF2TZVPP-157.7013502; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/test_set_A-L/Opt BHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimumwb97xdDEF2SVP-117.774701017; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/test_set_A-L/Opt AHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Geometry optimization Minimumwb97xdDEF2SVP-79.7456988974; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/test_set_A-L/SP E-SPHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-195.2930544; Eh
thumbnail.jpeg23-Jun-2026/Gaussian_output_files/test_set_A-L/SP F-SPHouk, Kendall N; Wang, Zuwei; Shao, Huiling; Wong, Audrey; Garg, Neil KGaussian; 16; ES64L-G16RevA.03Single point Structureuwb97xdDEF2TZVPP-234.641757; Eh
Results 402141-402150 of 402241 (Search time: 0.229 seconds).