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Item hits:

Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy
20-Feb-2023	SP1_crystal_md5	Curti, Mariano	Amber; 18	Molecular Dynamics	-	-	-258.56174135232; Eh
20-Feb-2023	SP1_crystal_md2	Curti, Mariano	Amber; 18	Molecular Dynamics	-	-	-258.548381088; Eh
22-Feb-2023	SP2_crystal_md0	Curti, Mariano	Amber; 18	Molecular Dynamics	-	-	-216.82628801471998; Eh
20-Feb-2023	SP1_crystal_EET	Curti, Mariano	Gaussian; 16; ES64L-G16RevB.01	Excitation energy transfer	RCAM-B3LYP; TD-FC	6-31G(D)	-2148.0267509; Eh
20-Feb-2023	SP2_crystal_EET	Curti, Mariano	Gaussian; 16; ES64L-G16RevB.01	Excitation energy transfer	RCAM-B3LYP; TD-FC	6-31G(D)	-2148.0089105; Eh
20-Feb-2023	SP3_design_EET	Curti, Mariano	Gaussian; 16; ES64L-G16RevB.01	Excitation energy transfer	RCAM-B3LYP; TD-FC	6-31G(D)	-2148.0244312; Eh
20-Feb-2023	SP1_design_EET	Curti, Mariano	Gaussian; 16; ES64L-G16RevB.01	Excitation energy transfer	RCAM-B3LYP; TD-FC	6-31G(D)	-2148.0254414; Eh
20-Feb-2023	SP2_design_EET	Curti, Mariano	Gaussian; 16; ES64L-G16RevB.01	Excitation energy transfer	RCAM-B3LYP; TD-FC	6-31G(D)	-2148.0329476; Eh
20-Feb-2023	SP1_crystal_md12	Curti, Mariano	Amber; 18	Molecular Dynamics	-	-	-258.56076208511996; Eh
20-Feb-2023	SP1_crystal_md11	Curti, Mariano	Amber; 18	Molecular Dynamics	-	-	-258.55850124479997; Eh

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