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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Nov-202018von Wolff, NiklasGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRM06LDEF2TZVP DEF2TZVP/W06-1405.82146168; Eh
thumbnail.jpeg19-Nov-202017von Wolff, NiklasGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRM06LDEF2TZVP DEF2TZVP/W06-1518.97020041; Eh
thumbnail.jpeg22-Mar-2020/M06L_BS1_optimized_structures m06l_clusterG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM06L6-31G(D,P) SDDALL GEN-2433.92229604; Eh
thumbnail.jpeg22-Mar-2020/M06L_BS1_optimized_structures m06l_pha_prod1G. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM06L6-31G(D,P) SDDALL GEN-2742.30222424; Eh
thumbnail.jpeg22-Mar-2020/M06L_BS1_optimized_structures m06l_phaG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM06L6-31G(D,P) GEN-308.356877978; Eh
thumbnail.jpeg22-Mar-2020/M06L_BS1_optimized_structures ga_m06l_dmadprodG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM06L6-31G(D,P) SDDALL GEN-2966.97467237; Eh
thumbnail.jpeg22-Mar-2020/M06L_BS1_optimized_structures ga_m06l_dmadG. Algarra, AndrésGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRM06L6-31G(D,P) GEN-533.024376520; Eh
thumbnail.jpeg25-Feb-2021//ht_paper_misc h2_h2o_m06l//ht_paper_misc/h2_h2o_m06l H2O m06l-H2OCraig, MichaelGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumRM06L6-31G(D,P) 6-31+G(D) GEN-76.4338163730; Eh
thumbnail.jpeg25-Feb-2021//ht_paper_misc h2_h2o_m06l//ht_paper_misc/h2_h2o_m06l H2 m06l-h2Craig, MichaelGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumRM06L6-31G(D,P) GEN-1.16757060113; Eh
thumbnail.jpeg8-Jun-2020i_M06-LChamkin, AleksandrGaussian; 09; ES64L-G09RevE.01Geometry optimization MinimumRM06LDEF2TZVPP DEF2TZVPP/FIT-1824.22750107; Eh
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