Axel Kohlmeyer 476446d93c add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00

..

hdnnp-data

rename example folders

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data.H2O-360mol

rename example folders

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in.hdnnp

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00

in.hybrid

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

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log.23Aug23.hdnnp.g++.1

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00

log.23Aug23.hdnnp.g++.4

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00

log.23Aug23.hybrid.g++.1

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00

log.23Aug23.hybrid.g++.4

add reference log outputs for ML-HDNNP and add input demoing use with hybrid

2023-08-23 08:58:20 -04:00