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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	13-Jul-2023	2-B10Br9Xe_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-23746.8440228; Eh
	13-Jul-2023	2-B10Br9Ar_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-23944.9285470; Eh
	13-Jul-2023	1-B10I9He_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-2932.32587922; Eh
	13-Jul-2023	1-B10I9Ne_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-3058.39236528; Eh
	13-Jul-2023	1-B10Cl9_to_2-B10Cl9_(Cl)	Kawa, Sebastian	Gaussian; 16; AS64L-G16RevC.01	Geometry optimization TS	RB3LYP	DEF2QZVPP	-4391.38811298; Eh
	13-Jul-2023	B6Cl5_(-)_B3LYP	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2TZVPP	-2450.57777375; Eh
	13-Jul-2023	B6I5He_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-1641.36668400; Eh
	13-Jul-2023	B6I5Ar_(-)	Kawa, Sebastian	Gaussian; 16; AS64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-2166.02643998; Eh
	13-Jul-2023	B6I5Kr_(-)	Kawa, Sebastian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-4392.30947838; Eh
	13-Jul-2023	B6I5Ne_(-)	Kawa, Sebastian	Gaussian; 16; AS64L-G16RevC.01	Geometry optimization Minimum	RB3LYP	DEF2QZVPP	-1767.43227840; Eh

Results 111-120 of 122 (Search time: 0.001 seconds).