Results 81 to 90 of about 19,335,962 (161)

Machine Learning Potential-Enabled Platform for the In Silico Design of Functional Organic Molecular Crystals. [PDF]

J Chem Inf Model
Bhat V, Risko C.
europepmc   +1 more source

Machine learning potential era of zeolite simulation. [PDF]

Chem Sci, 2022
Ma S, Liu ZP.
europepmc   +1 more source

Machine learning potential for modelling dynamic hydrogen bond networks in MOF MIL-120. [PDF]

Chem Sci
Jin X, Li Y, Gaedecke K, Zhang X, Smit B.   +4 more
europepmc   +1 more source

Student stress and mental health during online learning: Potential for post-COVID-19 school curriculum development. [PDF]

Compr Psychoneuroendocrinol, 2023
Nuryana Z, Xu W, Kurniawan L, Sutanti N, Makruf SA, Nurcahyati I.   +5 more
europepmc   +1 more source

Understanding the precipitation mechanism in pentavalent vanadium electrolytes through deep learning potential molecular dynamics. [PDF]

Chem Sci
Mu C, Zhan C, Li T, Li X.
europepmc   +1 more source

Proton Transport on Graphamine: A Deep-Learning Potential Study. [PDF]

J Phys Chem C Nanomater Interfaces
Ananthabhotla LY, Achar SK, Johnson JK.
europepmc   +1 more source

Machine learning potential for interacting dislocations in the presence of free surfaces. [PDF]

Sci Rep, 2022
Lanzoni D, Rovaris F, Montalenti F.
europepmc   +1 more source

Chromatin Profiling Reveals Distinct Male and Female Trajectories for Developmental Learning Potential. [PDF]

Dev Neurobiol
Kunzelman GW, Batistuzzo A, London SE.
europepmc   +1 more source

A foundation machine learning potential with polarizable long-range interactions for materials modelling. [PDF]

Nat Commun
Gao R, Yam C, Mao J, Chen S, Chen G, Hu Z.   +5 more
europepmc   +1 more source

Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF-NaF-ZrF₄ Molten Salt. [PDF]

JACS Au, 2022
Chahal R, Roy S, Brehm M, Banerjee S, Bryantsev V, Lam ST.   +5 more
europepmc   +1 more source