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Jun 1, 20233 min read
OpenMolcas: 2023 release
We have contributed to some of the new developments included in the latest release of the OpenMolcas electronic structure package...
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May 25, 20233 min read
Book chapter in Theoretical and Computational Photochemistry: nonlinear spectroscopies
We have contributed a book chapter reviewing different methods to model linear and nonlinear spectroscopies in molecular systems...
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Jun 1, 20212 min read
Molecular Excited State Calculations with Adaptive Wavefunctions on a Quantum Eigensolver Emulation
An adaptive scheme is used to reduce the cost of molecular excited states and increase their feasibility in Noisy Intermediate-Scale...
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