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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
1-Dec-2016	/ts_frequency 26_26_i	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-653.08544207; eV
1-Dec-2016	/ts_frequency 31_32_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-674.58406472; eV
17-Oct-2016	/Dimer/Al_H_I/Poly/IC_p IC_p	González Fabra, Joan	Gaussian; 09; EM64L-G09RevD.01	Geometry optimization Minimum	RB97D3	6-311G**	-3006.19892079; Eh
1-Dec-2016	/ts_frequency 26_15_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-656.27103176; eV
1-Dec-2016	/ts_frequency 24_33_r	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-659.38258072; eV
1-Dec-2016	/ts_frequency 23_22_r	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-669.70132823; eV
1-Dec-2016	/ts_frequency 22_31_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-674.25970921; eV
1-Dec-2016	/ts_frequency 01_11_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-667.14614128; eV
1-Dec-2016	/ts_frequency 26_14_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-655.83383552; eV
1-Dec-2016	/ts_frequency 01_01_i	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-662.99119939; eV

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