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1

Anharmonicity in Thermal Insulators: An Analysis from First..:

Knoop, Florian ; Purcell, Thomas A. R. ; Scheffler, Matthias.
Physical Review Letters. 130 (2023) 23 - p. , 2023

Link: https://doi.org/10.1103/..

2

Stress and heat flux via automatic differentiation:

Langer, Marcel F. ; Frank, J. Thorben ; Knoop, Florian
The Journal of Chemical Physics. 159 (2023) 17 - p. , 2023

Link: https://doi.org/10.1063/..

3

Ab initio Green-Kubo simulations of heat transport in solid..:

Knoop, Florian ; Scheffler, Matthias ; Carbogno, Christian
Physical Review B. 107 (2023) 22 - p. , 2023

Link: https://doi.org/10.1103/..

4

Heat flux for semilocal machine-learning potentials:

Langer, Marcel F. ; Knoop, Florian ; Carbogno, Christian..
Physical Review B. 108 (2023) 10 - p. , 2023

Link: https://doi.org/10.1103/..

5

Heat transport in strongly anharmonic solids from first pri..:

Knoop, Florian , 2022

Link: https://nbn-resolving.de..

6

High-pressure synthesis of seven lanthanum hydrides with a ..:

Laniel, Dominique ; Trybel, Florian ; Winkler, Bjoern...
Nature Communications. 13 (2022) 1 - p. , 2022

Link: https://doi.org/10.1038/..

7

FHI-vibes: Ab Initio Vibrational Simulations:

Knoop, Florian ; Purcell, Thomas ; Scheffler, Matthias.
Journal of Open Source Software. 5 (2020) 56 - p. 2671 , 2020

Link: https://doi.org/10.21105..

8

Anharmonicity measure for materials:

Knoop, Florian ; Purcell, Thomas A. R. ; Scheffler, Matthias.
Physical Review Materials. 4 (2020) 8 - p. , 2020

Link: https://doi.org/10.1103/..

9

TDEP:Temperature Dependent Effective Potentials:

Knoop, Florian ; Shulumba, Nina ; Castellano, Aloïs...
Journal of Open Source Software, 2024, 9:94,. , 2024

Link: http://urn.kb.se/resolve..

10

Stress and heat flux via automatic differentiation:

Langer, Marcel F ; Frank, J. Thorben ; Knoop, Florian
Journal of Chemical Physics, 0021-9606, 2023, 159:17,. , 2023

Link: http://urn.kb.se/resolve..

11

Ab initio Green-Kubo simulations of heat transport in solid..:

Knoop, Florian ; Scheffler, Matthias ; Carbogno, Christian
Physical Review B, 2469-9950, 2023, 107:22,. , 2023

Link: http://urn.kb.se/resolve..

12

Data and software: Heat flux for semi-local machine-learnin..:

Langer, Marcel F ; Knoop, Florian ; Carbogno, Christian..
info:eu-repo/grantAgreement/EC/H2020/740233/. , 2023

Link: https://zenodo.org/recor..

13

Anharmonicity in Thermal Insulators: An Analysis from First..:

Knoop, Florian ; Purcell, Thomas A. R ; Scheffler, Matthias.
Physical Review Letters, 0031-9007, 2023, 130:23,. , 2023

Link: http://urn.kb.se/resolve..

14

Data and software: Stress and heat flux via automatic diffe..:

Langer, Marcel Florin ; Frank, J. Thorben ; Knoop, Florian
info:eu-repo/grantAgreement/EC/H2020/740233/. , 2023

Link: https://zenodo.org/recor..

15

Heat flux for semi-local machine-learning potentials:

Langer, Marcel F ; Knoop, Florian ; Carbogno, Christian..
http://arxiv.org/abs/2303.14434. , 2023

Link: http://arxiv.org/abs/230..

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