Zobrazeno 1 - 10
of 52
pro vyhledávání: '"Juha, Tiihonen"'
Publikováno v:
The Journal of Physical Chemistry Letters. 14:3553-3560
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::3446049377bb5efbd7eba996944c0bd1
https://doi.org/10.1021/acs.jpclett.3c00497
https://doi.org/10.1021/acs.jpclett.3c00497
Autor:
Alexander Felfernig, Juha Tiihonen
Publikováno v:
Journal of Universal Computer Science, Vol 26, Iss 3, Pp 317-317 (2020)
Externí odkaz:
https://doaj.org/article/bb4f602284a046a7a6bace324868935c
Publikováno v:
The Journal of chemical physics. 156(5)
We present an efficient energy-based method for structural optimization with stochastic electronic structure theories, such as diffusion quantum Monte Carlo (DMC). This method is based on robust line-search energy minimization in reduced parameter sp
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6e87b3aea24f26e885c87cbe39754d3f
https://pubmed.ncbi.nlm.nih.gov/35135277
https://pubmed.ncbi.nlm.nih.gov/35135277
Autor:
Daniel, Staros, Guoxiang, Hu, Juha, Tiihonen, Ravindra, Nanguneri, Jaron, Krogel, M Chandler, Bennett, Olle, Heinonen, Panchapakesan, Ganesh, Brenda, Rubenstein
Publikováno v:
The Journal of chemical physics. 156(1)
The first magnetic 2D material discovered, monolayer (ML) CrI
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::fdc980591ec70a0f033e577a5309bd25
https://pubmed.ncbi.nlm.nih.gov/34998345
https://pubmed.ncbi.nlm.nih.gov/34998345
Diamagnetism is the response of dynamical compositions of charged particles, electrons, and nuclei, to an incident magnetic field. In this paper, we study how the finite temperature and finite nuclear masses affect the diamagnetic susceptibilities of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::04d79732eef93ec3aeed6fad6a320a60
http://urn.fi/URN:NBN:fi:jyu-202204262398
http://urn.fi/URN:NBN:fi:jyu-202204262398
Publikováno v:
The Journal of chemical physics. 154(20)
Quantum Monte Carlo (QMC) forces have been studied extensively in recent decades because of their importance with spectroscopic observables and geometry optimization. Here we benchmark the accuracy and statistical cost of QMC forces. The zero-varianc
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ab8b3d90b33c0bab877f8228130a19f4
https://pubmed.ncbi.nlm.nih.gov/34241166
https://pubmed.ncbi.nlm.nih.gov/34241166
Autor:
Mikko Raatikainen, Quim Motger, Clara Marie Lüders, Xavier Franch, Lalli Myllyaho, Elina Kettunen, Jordi Marco, Juha Tiihonen, Mikko Halonen, Tomi Männistö
Issue trackers, such as Jira, have become the prevalent collaborative tools in software engineering for managing issues, such as requirements, development tasks, and software bugs. However, issue trackers inherently focus on the lifecycle of single i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cc7f06cc3564728aebe4cf58eec43c54
http://arxiv.org/abs/2102.08485
http://arxiv.org/abs/2102.08485
Publikováno v:
Journal of Systems and Software
Context: A software product line is a means to develop a set of products in which variability is a central phenomenon captured in variability models. The field of SPLs and variability have been topics of extensive research over the few past decades.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1a5b0e6a37a23254b33cc0c4933b1366
http://hdl.handle.net/10138/299972
http://hdl.handle.net/10138/299972
Publikováno v:
Journal of chemical theory and computation. 14(11)
We demonstrate computation of total dynamic multipole polarizabilities using path-integral Monte Carlo method (PIMC). The PIMC approach enables accurate thermal and nonadiabatic mixing of electronic, rotational, and vibrational degrees of freedom. Th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::883b8b7f5ec2e7bdc06b6eb60a1273c4
https://pubmed.ncbi.nlm.nih.gov/30278124
https://pubmed.ncbi.nlm.nih.gov/30278124
Autor:
Ralph Samer, Tomi Männistö, Martin Stettinger, Mikko Raatikainen, Juha Tiihonen, Alexander Felfernig
Publikováno v:
SPLC (2)
Proceedings of the 22nd International Systems and Software Product Line Conference-Volume 2
Proceeedings of the 22nd International Conference on Systems and Software Product Line-SPLC 18-Volume 2
Proceeedings of the 22nd International Conference on Systems and Software Product Line-SPLC '18-Volume 2
Proceedings of the 22nd International Systems and Software Product Line Conference-Volume 2
Proceeedings of the 22nd International Conference on Systems and Software Product Line-SPLC 18-Volume 2
Proceeedings of the 22nd International Conference on Systems and Software Product Line-SPLC '18-Volume 2
The requirements for a system have many dependencies that can be expressed in the individual requirements managed in an issue tracker or a requirements management system. However, managing the entire body of requirements taking into account all compl
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::56e653ae4a3166984c5a096405b4c4ce
https://doi.org/10.1145/3236405.3236411
https://doi.org/10.1145/3236405.3236411