ioChem-BD Browse - Institute of Chemical Research of Catalonia: Search

Search

previous
1
2
3
4
5
6
...
11
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	1-Dec-2016	/ts_frequency 33_27_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-660.23851296; 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 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 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 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 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 23_27_c	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-671.59482828; 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_01_i	Li, Qiang	vasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complex	Frequencies	-	-	-662.99119939; eV

Results 21-30 of 105 (Search time: 0.002 seconds).