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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	15-Jul-2022	/Theozyme Theozyme_TS-3	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1340.98985926; Eh
	15-Jul-2022	/Water/mPW1PW91_6-31+G(d,p) TS2	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1264.56644473; Eh
	15-Jul-2022	/Water/mPW1PW91_6-31+G(d,p) TS5	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1568.74460119; Eh
	15-Jul-2022	/Water/mPW1PW91_6-31+G(d,p) TS1	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1341.00318019; Eh
	15-Jul-2022	/Water/mPW1PW91_6-31+G(d,p) TS4	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1264.57382810; Eh
	15-Jul-2022	/Chloroform/mPW1PW91_6-31+G(d,p) TS2	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1264.54953585; Eh
	15-Jul-2022	/Chloroform/mPW1PW91_6-31+G(d,p) TS4	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1264.55861767; Eh
	15-Jul-2022	/Chloroform/mPW1PW91_6-31+G(d,p) TS3	Soysal, Esra Nur	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1264.56318696; Eh
	15-Jul-2022	/Theozyme Theozyme_TS-6	Soysal, Esra Nur	Gaussian; 09; EM64L-G09RevB.01	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-
	10-Aug-2022	/Other_trials_G16/Figure_S9 TS1prime	Soysal, Esra Nur	Gaussian; 16; EM64L-G16RevA.03	Geometry optimization TS	RmPW1PW91	6-31+G(D,P)	-1340.98951965; Eh

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