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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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4/16/25

Error due to $ctd file not present in test IC-DFTB+-TDDFTB in newton-x v.2.6

Hello, I'm trying to run IC-DFTB+-TDDFTB with DFTB+ v24.1 and v.2.6 of newton-x. The error

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Error due to $ctd file not present in test IC-DFTB+-TDDFTB in newton-x v.2.6

Hello, I'm trying to run IC-DFTB+-TDDFTB with DFTB+ v24.1 and v.2.6 of newton-x. The error

4/16/25

12/5/24

line 1739"(f15.9,X,3i9,30f15.9)" in sh_mod.f90 ERROR “Fortran runtime error: Expected INTEGER for item 36 in formatted transfer, got REAL”

I'm using newtonx-2.6-b01 and gaussian16 C.01 I'm trying to run a non-adiabatic excited state

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line 1739"(f15.9,X,3i9,30f15.9)" in sh_mod.f90 ERROR “Fortran runtime error: Expected INTEGER for item 36 in formatted transfer, got REAL”

I'm using newtonx-2.6-b01 and gaussian16 C.01 I'm trying to run a non-adiabatic excited state

12/5/24

Mariana Guedes Mariana, … prabhash mahata3

6/15/25

NX-columbus interface problems

Hi Mariana Guedes Mariana, As far as I used, The memory specification can be changed according when

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NX-columbus interface problems

Hi Mariana Guedes Mariana, As far as I used, The memory specification can be changed according when

6/15/25

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