Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Fernand Louisnard"'
Publikováno v:
Theoretical Chemistry Accounts: Theory, Computation, and Modeling
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2022, 141 (7), pp.36. ⟨10.1007/s00214-022-02894-6⟩
Theoretical Chemistry Accounts: Theory, Computation, and Modeling, 2022, 141 (7), pp.36. ⟨10.1007/s00214-022-02894-6⟩
International audience
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::aeee8da790c40bc2dc9359e87aa4c60c
https://hal.science/hal-03740620
https://hal.science/hal-03740620
Publikováno v:
Theoretical Chemistry Accounts. 140
The parallel-tempering molecular dynamics (PTMD) method is a key computational tool to explore complex potential energy surfaces. As a result of its computational cost, it has mainly been coupled to force-field approaches despite the interest it coul
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::23d450e6e9ed872734fb0e496daa6ea9
https://doi.org/10.1007/s00214-021-02765-6
https://doi.org/10.1007/s00214-021-02765-6
