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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-Feb-2022TpBr3CuN_SiH_s_v1_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.8584555; Eh
thumbnail.jpeg11-Feb-2022TpBr3CuN_SiH_s_v2_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.8544274; Eh
thumbnail.jpeg11-Feb-2022step_014_s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.8723553; Eh
thumbnail.jpeg11-Feb-2022step_016_s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.8852933; Eh
thumbnail.jpeg11-Feb-2022step_013_s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.864252; Eh
thumbnail.jpeg11-Feb-2022step_017_s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.8869224; Eh
thumbnail.jpeg11-Feb-2022step_015_s_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPDEF2TZVP DEF2QZVP GEN-26981.878527; Eh
thumbnail.jpeg11-Feb-2022TpBr3CuN_t_v3_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPDEF2TZVP DEF2QZVP GEN-26380.0883161; Eh
thumbnail.jpeg12-Feb-2022MECP_s_freqPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPLANL2DZ 6-31G(D,P) GENECP-2487.68161421; Eh
thumbnail.jpeg11-Feb-2022TpBr3Cu_HNSi_t_v1_SPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Single point StructureUB3LYPDEF2TZVP DEF2QZVP GEN-26981.867272; Eh
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