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Hello, Adi <3

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Article list:

[[Mod:NIK13|Transition States write-up]]

[[Mod:NIK13additionalfiles|Transition States movable molecules]]

File upload list:
Nik13_Transition_States_A_15hdene_Opt_B3LYP631Gd_anti2.mol2
Nik13_Transition_States_A_Cope_boatTS_Opt%2BFreq_B3LYP631Gd.mol
NIK13_TRANSITION_STATES_A_COPE_CHAIRTS_OPT%2BFREQ_B3LYP631GD.mol2
Nik13_Transition_States_A_15hdene_Opt_HF321G_anti2.mol
NIK13 TRANSITION STATES COPE CHAIRTS OPT+FREQ B3LYP631GD LOGMOS.LOG
NIK13 TRANSITION STATES COPE BOATTS OPT+FREQ B3LYP631GD LOGMOS.LOG

[[:File:Nik13_Transition_States_A_15hdene_Freq_B3LYP631Gd_anti2_predicted_IR_spectrum.png|Nik13_Transition_States_A_15hdene_Freq_B3LYP631Gd_anti2_predicted_IR_spectrum.png]]

[[:File:Nik13_Transition_States_Bi_eene_OptMin_semiAM1_HOMO.png|Nik13_Transition_States_Bi_eene_OptMin_semiAM1_HOMO.png]]

[[:File:Nik13_Transition_States_Bi_eene_OptMin_semiAM1_LUMO.png|Nik13_Transition_States_Bi_eene_OptMin_semiAM1_LUMO.png]]

[[:File:Nik13_Transition_States_Bi_bdene_OptMin_semiAM1_HOMO.png|Nik13_Transition_States_Bi_bdene_OptMin_semiAM1_HOMO.png]]

[[:File:Nik13_Transition_States_Bi_bdene_OptMin_semiAM1_LUMO.png|Nik13_Transition_States_Bi_bdene_OptMin_semiAM1_LUMO.png]]

[[:File:NIK13_TRANSITION_STATES_BII_BDENE-EENE_OPT+FREQ_TSBERNY_FC_SEMIAM1_NOEIGEN.LOG|NIK13_TRANSITION_STATES_BII_BDENE-EENE_OPT+FREQ_TSBERNY_FC_SEMIAM1_NOEIGEN.LOG]]

[[:File:NIK13_TRANSITION_STATES_BII_BDENE-EENE_OPT+FREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_LOGMOS.LOG|NIK13_TRANSITION_STATES_BII_BDENE-EENE_OPT+FREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_LOGMOS.LOG]]

[[:File:Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen.mol|Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen.mol]]

[[:File:Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_HOMO.png|Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_HOMO.png]]

[[:File:Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_LUMO.png|Nik13_Transition_States_Bii_bdene-eene_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_LUMO.png]]

[[:File:NIK13_TRANSITION_STATES_BII_CH13DENE-MALANH_OPT%2BFREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_ENDO_LOGMOS.LOG|NIK13_TRANSITION_STATES_BII_CH13DENE-MALANH_OPT%2BFREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_ENDO_LOGMOS.LOG]]

[[:File:Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Endo_HOMO_side.png|Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Endo_HOMO_side.png]]

[[:File:Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Endo_HOMO_top.png|Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Endo_HOMO_top.png]]

[[:File:NIK13_TRANSITION_STATES_BII_CH13DENE-MALANH_OPT%2BFREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_EXO_LOGMOS.LOG|NIK13_TRANSITION_STATES_BII_CH13DENE-MALANH_OPT%2BFREQ_TSBERNY_FC_SEMIAM1_NOEIGEN_EXO_LOGMOS.LOG]]

[[:File:Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Exo_HOMO_side.png|Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Exo_HOMO_side.png]]

[[:File:Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Exo_HOMO_top.png|Nik13_Transition_States_Bii_ch13dene-malanh_Opt%2BFreq_TSBerny_FC_semiAM1_NoEigen_Exo_HOMO_top.png]]