1. Barcelona Supercomputing Center

Browsing by Author Petrus, Enric

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Showing results 1 to 20 of 5076  next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required25-Oct-20243Petrus, EnricOrcaSingle pointDFTdef2-tzvp-797919.1563118949; Eh
Login required25-Oct-202430Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-497467.0272178317; Eh
Login required25-Oct-2024300Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797620.1984959211; Eh
Login required25-Oct-2024301Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797907.6343031642; Eh
Login required25-Oct-2024302Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797829.6724138093; Eh
Login required25-Oct-2024303Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-798027.2418755555; Eh
Login required25-Oct-2024304Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-599280.3988719691; Eh
Login required25-Oct-2024305Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-798346.6606182969; Eh
Login required25-Oct-2024306Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-798024.8872685243; Eh
Login required25-Oct-2024307Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797824.520667871; Eh
Login required25-Oct-2024308Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-794865.6400445311; Eh
Login required25-Oct-2024309Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797770.3527562703; Eh
Login required25-Oct-202431Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797891.2454512329; Eh
Login required25-Oct-2024310Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797907.0368312288; Eh
Login required25-Oct-2024311Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797787.7854401701; Eh
Login required25-Oct-2024312Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797736.3780029255; Eh
Login required25-Oct-2024313Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797768.6384494142; Eh
Login required25-Oct-2024314Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-400059.7426867423; Eh
Login required25-Oct-2024315Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797752.0178166605; Eh
Login required25-Oct-2024316Petrus, EnricOrca; 5.0.3; RELEASESingle pointDFTdef2-tzvp-797769.2147501739; Eh
Showing results 1 to 20 of 5076  next >