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DetCI, error while reading CI vector from TURBOMOLE output

Status: Open.

#48 In orbkit/orbkit;

· adam-srut opened on Jan 8, 2026

Error C1083 while installing orbkit on PyCharm

Status: Open.

#47 In orbkit/orbkit;

· Pot2peinturebleu opened on Apr 30, 2024

Issue with molden files generate by tm2molden

Status: Open.

#46 In orbkit/orbkit;

· Audiochemie opened on Nov 14, 2023

Error in compiling

Status: Open.

#44 In orbkit/orbkit;

· andre-cloud opened on Dec 5, 2021

detCi with TURBOMOLE input aborts at transition density

Status: Open.

#43 In orbkit/orbkit;

· dgemeri opened on Oct 11, 2021

What is line 370 of function 'read_molden' in /read/molden.py expecting to read?

Status: Open.

#41 In orbkit/orbkit;

· srk opened on Jul 20, 2021

.WFN/.WFX/MOLDEN files from Electron Density operator in detCI@OrbKit ?

Status: Open.

#40 In orbkit/orbkit;

· srk opened on Jun 28, 2021

ao_spherical is different with the manual

Status: Open.

#33 In orbkit/orbkit;

· Jaewook-Kim opened on May 26, 2020

MO norm and orthogonality

Status: Open.

#32 In orbkit/orbkit;

· FGueganUP opened on Apr 10, 2020

Wrong dipole moment for psi4 with Cartesian basis functions

Status: Open.

#28 In orbkit/orbkit;

· vpohl opened on Aug 26, 2019