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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	31-Mar-2023	Methamphetamine_0d	Ieritano, Christian; Haack, Alexander	Orca; 5.0.3; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-445.26320135; Eh
	31-Mar-2023	Methamphetamine_0e	Ieritano, Christian; Haack, Alexander	Orca; 5.0.3; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-445.25943693; Eh
	31-Mar-2023	TOLNAFTATE_3	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-1262.85983974; Eh
	31-Mar-2023	TOLNAFTATE_2	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-1262.87062574; Eh
	31-Mar-2023	BROMUCONAZOL_R_2	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-4237.14472003; Eh
	31-Mar-2023	BROMUCONAZOL_R_3	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-4237.14575674; Eh
	31-Mar-2023	BROMUCONAZOL_R_4	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-4237.14472002; Eh
	31-Mar-2023	CHLORANTRANILIPROLE_5	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-4613.67227898; Eh
	31-Mar-2023	CHLORANTRANILIPROLE_4	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-4613.68460042; Eh
	31-Mar-2023	CHLORBROMURON_1	Ieritano, Christian; Haack, Alexander	Orca; 5.0.2; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3643.73513273; Eh

Results 1001-1010 of 1038 (Search time: 0.002 seconds).