Published November 1, 2022 | Version v1
Dataset Open

Progeny Project DFT data for MW1, MW2 and MW8 surfactant molecules

  • 1. University of Bremen, BCCMS

Description

DFT data, i.e. geometries, electronic eigenvalues, wave function "molden format" data and RESP charges

for the MW1, MW2 and MW8 surfactants of the Progeny Project.

See Readme.txt for more details.

Files

Files (3.9 GB)

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md5:3ca20d3410a07a62cddf8d61d188b14b
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Additional details

Funding

European Commission
PROGENY – Proto-Opto-Electro-Mechanical Hybrid Systems for Generation-Next Bionic Devices 899205