Search

Current filters:
Add filters:
Item hits:
PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegFe_nn-PCo4-Evac-b3lyp-hsall-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7659.89524664; Eh
thumbnail.jpegFe_nnHS-PCo4-Eo-b3lyp-ls-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7734.99462620; Eh
thumbnail.jpegFe_nnHS-PCo4-Eoh-b3lyp-ls-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7735.66754714; Eh
thumbnail.jpegSiCo4-Eooh-b3lyp-ls-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7729.11226714; Eh
thumbnail.jpegSiCo4-Evac-b3lyp-hs-pcm-disp-bbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7578.19824197; Eh
thumbnail.jpegSiCo4-Eoh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7653.97569402; Eh
thumbnail.jpegMn_N-SiCo3-Eo-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7612.22740804; Eh
thumbnail.jpegMn_N-SiCo3-Eoh-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7612.89645144; Eh
thumbnail.jpegFePCo3-Evac-b3lyp-hs-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7659.89844442; Eh
thumbnail.jpegFe_N-PCo3-Eoh-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7735.70643949; Eh
thumbnail.jpegNi_N-PCo3-Eooh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7856.63374354; Eh
thumbnail.jpegGeCo4-Eooh-b3lyp-ls-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-11299.4347877; Eh
thumbnail.jpegGeCo4-Evac-b3lyp-hs-pcmb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-11148.5195613; Eh
thumbnail.jpegGeCo4-Eoh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-11224.2975612; Eh
thumbnail.jpegFe_N-AlCo3-Evac-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7462.67548128; Eh
thumbnail.jpegFe_N-AlCo3-EoohIV-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7613.45008350; Eh
thumbnail.jpegFe_N-AlCo3-Eoh-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7538.49485077; Eh
thumbnail.jpegAlCo4-Eooh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7635.22507119; Eh
thumbnail.jpegAlCo4-Evac-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7484.30149916; Eh
thumbnail.jpegAlCo4-Eoh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7560.08706499; Eh
thumbnail.jpegPCo4-Eooh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7832.43197327; Eh
thumbnail.jpegPCo4-Evac-b3lyp-hs-pcm-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7681.52391173; Eh
thumbnail.jpegPCo4-Eo-b3lyp-ls-pcm-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7756.62294521; Eh
thumbnail.jpegPCo4-Eoh-b3lyp-ls-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7757.29576165; Eh
thumbnail.jpegMnIII_N-AlCo3-Eooh-b3lyp-hs-pcmbb-freqCraig, MichaelGaussian; 09; ES64L-G09RevE.01UB3LYPLANL2DZ 6-31G(D) 6-31G(D,P) GEN-7594.00262070; Eh
Results 1-25 of 31 (Search time: 0.035 seconds).