Replication data of C6 group for: "Disentanglement of surface and confinement effects for diene metathesis in mesoporous confinement"
I. Tischler, A. Schlaich, and C. Holm. Software, (2023)Related to: Ingo Tischler, Alexander Schlaich, Christian Holm. Disentanglement of Surface and Confinement Effects for Diene Metathesis in Mesoporous Confinement. ACS Omega 2023. doi: 10.1021/acsomega.3c06195.
DOI: 10.18419/darus-3642
Abstract
The simulation scripts and the simulation data of the journal article mentioned under related publications from C6 group can be found here. The data is structured according to figures and schemes in the research article and contains the following data types: compressed (tar) text data files and python scripts. The structure within the tar file is according to the different simulations, where we looked at different systems (bulk, flat, slit, pore), the different system diameters (width_x.x) and the different lengths of the polymers (l_22, l_29). The analysis scripts calculate all the necessary data from these systems.
Tischler, Ingo/Institute for Computational Physics, University of Stuttgart, Schlaich, Alexander/Institute for Computational Physics, University of Stuttgart, Holm, Christian/Institute for Computational Physics, University of Stuttgart
Related to: Ingo Tischler, Alexander Schlaich, Christian Holm. Disentanglement of Surface and Confinement Effects for Diene Metathesis in Mesoporous Confinement. ACS Omega 2023. doi: 10.1021/acsomega.3c06195
%0 Generic
%1 tischler2023replication
%A Tischler, Ingo
%A Schlaich, Alexander
%A Holm, Christian
%D 2023
%K darus mult ubs_10008 ubs_10018 ubs_10021 ubs_20014 ubs_20019 ubs_20023 ubs_30136 ubs_30165 ubs_30203 ubs_40216 unibibliografie
%R 10.18419/darus-3642
%T Replication data of C6 group for: "Disentanglement of surface and confinement effects for diene metathesis in mesoporous confinement"
%X The simulation scripts and the simulation data of the journal article mentioned under related publications from C6 group can be found here. The data is structured according to figures and schemes in the research article and contains the following data types: compressed (tar) text data files and python scripts. The structure within the tar file is according to the different simulations, where we looked at different systems (bulk, flat, slit, pore), the different system diameters (width_x.x) and the different lengths of the polymers (l_22, l_29). The analysis scripts calculate all the necessary data from these systems.
@misc{tischler2023replication,
abstract = {The simulation scripts and the simulation data of the journal article mentioned under related publications from C6 group can be found here. The data is structured according to figures and schemes in the research article and contains the following data types: compressed (tar) text data files and python scripts. The structure within the tar file is according to the different simulations, where we looked at different systems (bulk, flat, slit, pore), the different system diameters (width_x.x) and the different lengths of the polymers (l_22, l_29). The analysis scripts calculate all the necessary data from these systems. },
added-at = {2024-01-12T10:56:04.000+0100},
affiliation = {Tischler, Ingo/Institute for Computational Physics, University of Stuttgart, Schlaich, Alexander/Institute for Computational Physics, University of Stuttgart, Holm, Christian/Institute for Computational Physics, University of Stuttgart},
author = {Tischler, Ingo and Schlaich, Alexander and Holm, Christian},
biburl = {https://puma.ub.uni-stuttgart.de/bibtex/2cf7bcedb70f83640a35aab6a44317db3/unibiblio},
doi = {10.18419/darus-3642},
howpublished = {Software},
interhash = {e6b095210a08193fd8291b422b255515},
intrahash = {cf7bcedb70f83640a35aab6a44317db3},
keywords = {darus mult ubs_10008 ubs_10018 ubs_10021 ubs_20014 ubs_20019 ubs_20023 ubs_30136 ubs_30165 ubs_30203 ubs_40216 unibibliografie},
note = {Related to: Ingo Tischler, Alexander Schlaich, Christian Holm. Disentanglement of Surface and Confinement Effects for Diene Metathesis in Mesoporous Confinement. ACS Omega 2023. doi: 10.1021/acsomega.3c06195},
orcid-numbers = {Tischler, Ingo/0000-0001-8986-7679, Schlaich, Alexander/0000-0002-4250-363X, Holm, Christian/0000-0003-2739-310X},
timestamp = {2024-01-12T10:56:04.000+0100},
title = {Replication data of C6 group for: "Disentanglement of surface and confinement effects for diene metathesis in mesoporous confinement"},
year = 2023
}