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Dear Colleague,
Welcome to the
Newton-X
discussion group, a public forum for support on the platform.
Cheers!
Mario
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Adrian Müller
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Rafael Souza
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1/17/25
S1/S0 SF-TDDFT FSSH
Hello, Two possible problems are that ORCA 6 changed the output and that the ORCA interface
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Orca
S1/S0 SF-TDDFT FSSH
Hello, Two possible problems are that ORCA 6 changed the output and that the ORCA interface
1/17/25