NMR-SHARC : NMR references


Back to the NMR-SHARC homepage
NMR-SHARC LOGO LINE -------------------

Supported Methods:
SHARC GIAO/RHF/G98/6-311+GDP 	//RMP2-FC/6-31GDP

SHARC GIAO/MP2/G98/6-311+GDP 	//RMP2-FC/6-31GDP

SHARC GIAO-G94/RHF/6-311GD  	//RQCISD-FC/6-31GD   

SHARC GIAO-G94/B3LYP/6-311+GDP 	//RMP2-FC/6-31GDP   

SHARC GIAO-G94/RHF/6-311+GDP   //RQCISD-FC/6-31GD   

SHARC GIAO-G94/RHF/6-311+GDP   //RMP2-FC/6-31GDP   

SHARC GIAO-G94/B3LYP/6-311GD   //RMP2-FC/6-31GDP   

SHARC GIAO-G94/B3LYP/6-311+GDP	//RQCISD-FC/6-31GD   

SHARC GIAO-G94/B3LYP/6-311GD   //RQCISD-FC/6-31GD   

SHARC IGAIM-G94/RHF/6-311+GDP	//B3LYP/6-311+GDP

SHARC IGAIM-G94/RHF/6-311+GDP 	//RMP2-FC/6-31GD 

SHARC GIAO-G94/RHF/6-311+GDP 	//RMP2-FC/6-31+GDP

SHARC LORG/6-311+G3DP 		//RMP2-FU/6-311+GDP

SHARC CO-LORG/6-311+G3DP 	//RMP2-FU/6-311+GDP

SHARC LORG/6-311+G2DP 		//RMP2-FU/6-311+GDP

SHARC CO-LORG/6-311+G2DP 	//RMP2-FU/6-311+GDP

SHARC GIAO-G94/RHF/6-311+GDP //RHF/LAN1DZ

SHARC GIAO-G94/RHF/6-311GD 	//RHF/LAN1DZ

SHARC GIAO-G94/RHF/6-31+GD 	//RHF/LAN1DZ

SHARC GIAO-G94/RHF/B2 		//RHF/LAN1DZ

SHARC GIAO-G94/RHF/SHA_tz 	//RHF/LAN1DZ

SHARC GIAO-G94/RHF/6-31+GD 	//RMP2-FC/6-31GD

SHARC GIAO-G94/RHF/LANL1DZ 	//RHF/LAN1DZ

SHARC GIAO-G94/RHF/SHA_tz_Pol1 //RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/SHA_tz_Pol2 //RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-311+G2DP //RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-311+G3DP 	//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-311GDP 	//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-31GDP 		//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-31+GD 		//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/B2 			//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/SHA_tz 		//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-311GD 		//RMP2-FC/6-31+GDP

SHARC GIAO-G94/RHF/6-31+GDP 	//RMP2-FC/6-31+GDP

SHARC GIAO/B3LYP/G03/SDD 		//RB3LYP/6-31+GD

SHARC GIAO/B3LYP/G03/6-31GD 	//RB3LYP/6-31+GD

SHARC GIAO/B3LYP/G03/6-31+GD 	//RB3LYP/6-31+GD

SHARC GIAO/B3LYP/G03/6-311GD 	//RB3LYP/6-31+GD


NMR-SHARC LOGO LINE -------------------
Back to the NMR-SHARC homepage
Last Update 0.2 2012-10-14 by Alk Dransfeld