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Johannes Hoja

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Senior Scientist

University of Graz

Austria

Research Interests

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Vibrational Spectroscopy for Molecular Crystals via Quantum-Mechanical Embedding Methods

Open Date: 2020-01-01

Close Date: 2022-01-01

Articles (4)

Year:

2024

Year:

2024

Year:

2024

Year:

2023

Collaborators (3)

Álvaro Vázquez-Mayagoitia

Argonne National Laboratory

UNITED STATES

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Robert DiStasio

Assistant Professor

Cornell University

UNITED STATES

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Adrian Daniel Boese

University Professor

Karl-Franzens-Universität Graz

AUSTRIA

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Johannes Hoja

Research Interests

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Recent Grants

Articles (4)

The V30 benchmark set for anharmonic vibrational frequencies of molecular dimers

Dissociation Energies via Embedding Techniques

Multimer Embedding Approach for Molecular Crystals up to Harmonic Vibrational Properties

“Freedom of design” in chemical compound space: towards rational in silico design of molecules with targeted quantum-mechanical properties

Collaborators (3)

Álvaro Vázquez-Mayagoitia

Robert DiStasio

Adrian Daniel Boese

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