Search

Current filters:
Add filters:
  • previous
  • 1
  • next
Item hits:
PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeglarge_basis_A-5-I_NiITMe2_IPh_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-311+G(d,p)-1179.66794041; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-I_NiITMe2_IPh_ossts_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1179.64172017; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-I_NiITMe2_IPh_ossts_t_ts_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1179.66802572; Eh
thumbnail.jpegsmall_basis_A-4-I_NiIPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1179.49143667; Eh
thumbnail.jpegsmall_basis_A-3-I_cis-NiIPhITMe2_sqpMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1179.48232297; Eh
thumbnail.jpegsmall_basis_A-5-I_NiITMe2IPhMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1179.39175512; Eh
thumbnail.jpegsmall_basis_TS-A-5-6-I_NiITMe2_IPh_ossts_fIMes_t_opt_fixMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-1179.39174386; Eh
thumbnail.jpeglarge_basis_A-3-I_cis-NiIPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-311+G(d,p)-1179.75532412; Eh
thumbnail.jpeglarge_basis_A-4-I_trans-NiIPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-311+G(d,p)-1179.76388985; Eh
Results 1-9 of 9 (Search time: 0.003 seconds).