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Author

  • Ralf Meyer
2018

Applicability of Neural Network-based Approaches to SCF Initial Guess Generation

Cartus, J. J., Meyer, R. & Hauser, A., Sep 2018, 68th Annual Meeting of the Austrian Physical Society. Graz: Verlag der Technischen Universität Graz, p. 101

Research output: Chapter in Book/Report/Conference proceedingConference contribution

2016
2018
Open Access
2017

Lowest electronic states of alkali (Li, Na, K, Rb) – alkaline-earth (Ca, Sr) diatomic molecules

Pototschnig, J. V., Meyer, R., Hauser, A. & Ernst, W. E., Aug 2017, p. 599.

Research output: Contribution to conferenceAbstract

2018

A comparison of machine learning algorithms for transition state searches in computational chemistry

Schmuck, K., Meyer, R. & Hauser, A., Sep 2018, 68th Annual Meeting of the Austrian Physical Society. Graz: Verlag der Technischen Universität Graz, p. 101

Research output: Chapter in Book/Report/Conference proceedingConference contribution

2020
Open Access
2018

Temperature Studies of Ni@Au and Co@Au Core@Shell Systems on the Nanoscale

Schiffmann, A., Schnedlitz, M., Meyer, R., Lasserus, M. I., Messner, R., Lackner, F., Knez, D., Hofer, F., Hauser, A. & Ernst, W. E., 6 Feb 2018.

Research output: Contribution to conferencePoster

On the Unexpected Alloying Behaviour of Ni-Au and Co-Au Core-Shell Nanoparticles,

Hauser, A., Schnedlitz, M., Lasserus, M. I., Meyer, R., Ernst, W. E., Knez, D., Hofer, F., Fernandez-Perea, R. & De Lara-Castells, M. P., Dec 2018, p. 1.

Research output: Contribution to conferenceAbstract

2016

Interpolation of Potential Energy Surfaces Using Force Field Methods

Meyer, R. & Hauser, A., Sep 2016, p. 150. 1 p.

Research output: Contribution to conferenceAbstract

2018

Chiral Separation via Molecular Sieving: A Computational Screening of Suitable Functionalizations for Nanoporous Graphene

Fruehwirth, S. M., Meyer, R. & Hauser, A. W., 18 Sep 2018, In : ChemPhysChem. 19, 18, p. 2331-2339 9 p.

Research output: Contribution to journalArticle

2016

Model calculations for coherent optical transfer in alkali-strontium molecules

Pototschnig, J. V., Meyer, R., Hauser, A. & Ernst, W. E., Sep 2016, p. 94. 1 p.

Research output: Contribution to conferenceAbstract

2017
2018

Neural network based embedded atom model potentials for metallic nanoparticles

Meyer, R., Ernst, W. E. & Hauser, A., Sep 2018, 68th Annual Meeting of the Austrian Physical Society. Graz: Verlag der Technischen Universität Graz, p. 27

Research output: Chapter in Book/Report/Conference proceedingConference contribution

2020
2017

Electronic excitation and nuclear motion of atomic dopants in He nanodroplets

Hauser, A., Schnedlitz, M., Pototschnig, J. V., Meyer, R. & Ernst, W. E., Oct 2017, p. 18.

Research output: Contribution to conferenceAbstract

Influence of spin-orbit quenching on the solvation of indium in helium droplets

Meyer, R., Pototschnig, J. V., Ernst, W. E. & Hauser, A., Jun 2017.

Research output: Contribution to conferenceAbstract

2018

Embedded atom model potentials for metallic nanoparticles based on neural networks

Meyer, R., Fuchs, A. & Hauser, A., Jun 2018, p. 27. 1 p.

Research output: Contribution to conferenceAbstract

A neural network based approach to SCF initial guesses

Cartus, J. J., Meyer, R. & Hauser, A., Jun 2018, p. 50. 1 p.

Research output: Contribution to conferenceAbstract

Temperature studies of Ni@Au and Co@Au core@shell systems on the nanoscale

Schiffmann, A., Schnedlitz, M., Meyer, R., Lasserus, M. I., Messner, R., Lackner, F., Hauser, A., Ernst, W. E., Knez, D. & Hofer, F., Feb 2018. 1 p.

Research output: Contribution to conferenceAbstract

To be or not to be alloyed: The unexpected behaviour of Ni-Au and Co-Au core-shell nanoparticles upon heating

Schnedlitz, M., Knez, D., Meyer, R., Lasserus, M. I., Messner, R., Schiffmann, A., Lackner, F., Hauser, A., Hofer, F. & Ernst, W. E., Sep 2018, 68th Annual Meeting of the Austrian Physical Society. Graz: Verlag der Technischen Universität Graz, p. 82

Research output: Chapter in Book/Report/Conference proceedingConference contribution