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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Apr-2026	/Triplets_and_Bond_Dissociation_Energies 31-3_wB97XD_def2svp_SMD-DCM_ener_opt_freq	Serapian, Stefano A.	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	UwB97XD	DEF2SVP	-1434.75869956; Eh
	2-Apr-2026	/Triplets_and_Bond_Dissociation_Energies 42_wB97XD_def2svp_SMD-DCM_ener_opt_freq	Serapian, Stefano A.	Gaussian; 16; ES64L-G16RevC.02	Geometry optimization Minimum	RwB97XD	DEF2SVP	-1205.44061319; Eh
	19-Jan-2026	pd_slab_constant_potential_bare_supercell_1x1_1_002	Brennan-Pollak, Conor	vasp; 6.4.2; 20Jul23 (build May 01 2024 18:10:19) complex	Single point	DFT	-	-7.14619134; eV
	19-Jan-2026	pd_slab_constant_potential_h_7_freq	Brennan-Pollak, Conor	vasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complex	Frequencies	DFT	-	-54.96940938; eV
	19-Jan-2026	ni_constant_potential_h_1	Brennan-Pollak, Conor	vasp; 6.4.2; 20Jul23 (build May 01 2024 18:10:19) complex	Single point	DFT	-	-55.03092719; eV
	19-Jan-2026	pd_slab_constant_potential_oh_4_top_1_006	Brennan-Pollak, Conor	vasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complex	Geometry optimization	DFT	-	-78.85524689; eV
	19-Jan-2026	pd_slab_constant_potential_h_1_fcc_dipole	Brennan-Pollak, Conor	vasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complex	Geometry optimization	DFT	-	-34.30305420; eV
	19-Jan-2026	pd_slab_constant_potential_o_2_0_996	Brennan-Pollak, Conor	vasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complex	Geometry optimization	DFT	-	-35.62855773; eV
	19-Jan-2026	pd_slab_constant_potential_oh_3_top_freq	Brennan-Pollak, Conor	vasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complex	Frequencies	DFT	-	-61.07915107; eV
	19-Jan-2026	cu_constant_potential_o_3_1_004	Brennan-Pollak, Conor	vasp; 6.4.2; 20Jul23 (build May 01 2024 18:10:19) complex	Single point	DFT	-	-43.37964410; eV

Results 393421-393430 of 397867 (Search time: 0.255 seconds).