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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Jul-2022	/Chloroform/mPW1PW91_6-31+G(d,p) intermediate_B	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1264.57152917; Eh
	15-Jul-2022	/Theozyme intermediate_7	Soysal, Esra Nur	Gaussian; 09; EM64L-G09RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-
	10-Aug-2022	/Theozyme_G16 intermediate_5	Soysal, Esra Nur	Gaussian; 16; EM64L-G16RevA.03	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1417.46750352; Eh
	10-Aug-2022	/Theozyme_G16 intermediate_7	Soysal, Esra Nur	Gaussian; 16; EM64L-G16RevA.03	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1496.83095760; Eh
	10-Aug-2022	/Theozyme_G16 intermediate_6	Soysal, Esra Nur	Gaussian; 16; EM64L-G16RevA.03	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1454.34745738; Eh
	15-Jul-2022	/Theozyme intermediate_1	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1341.03959245; Eh
	15-Jul-2022	/Theozyme intermediate_2	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-1341.03966144; Eh
	15-Jul-2022	/Other_trials/Figure_S11 intermediate_A2-a	Soysal, Esra Nur	Gaussian; 09; EM64L-G09RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-
	15-Jul-2022	/Other_trials/Figure_S11 intermediate_A2-b	Soysal, Esra Nur	Gaussian; 09; EM64L-G09RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-
	15-Jul-2022	/Other_trials/Figure_S11 intermediate_A2	Soysal, Esra Nur	Gaussian; 09; EM64L-G09RevB.01	Geometry optimization Minimum	RmPW1PW91	6-31+G(D,P)	-

Results 21-30 of 181 (Search time: 0.001 seconds).