ioChem-BD Browse - Barcelona Supercomputing Center: Search

Search

previous
1
2
3
4
...
11
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Oct-2023	4f_valence,_3_te,_label_166	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.30549973; eV
	23-Oct-2023	4f_valence,_3_te,_label_156	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.46505662; eV
	23-Oct-2023	4f_valence,_3_te,_label_146	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.24715736; eV
	23-Oct-2023	4f_valence,_3_te,_label_145	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.45796249; eV
	23-Oct-2023	4f_valence,_3_te,_label_136	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.33288857; eV
	23-Oct-2023	4f_valence,_3_te,_label_135	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.44477388; eV
	23-Oct-2023	4f_valence,_3_te,_label_134	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.24767030; eV
	23-Oct-2023	4f_valence,_3_te,_label_133	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.31606258; eV
	23-Oct-2023	4f_valence,_3_te,_label_126	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.37269777; eV
	23-Oct-2023	4f_valence,_3_te,_label_125	Bruix, Albert	vasp; 5.4.1; 24Jun15 (build Jul 19 2019 12:04:57) gamma-only	Geometry optimization	DFT	-	-701.47259087; eV

Results 1-10 of 110 (Search time: 0.001 seconds).