Results 291 to 300 of about 527,698 (329)

Mapping adsorption on ionic surfaces via a pairwise potential-based high-throughput approach. [PDF]

J Appl Crystallogr
Mates-Torres E, Ugliengo P, Rimola A.
europepmc   +1 more source

Ketone-Assisted Alkoxysilane Condensation to Form Siloxane Bonds. [PDF]

Molecules
Rubinsztajn S, Cypryk M, Kurjata J, Kwiatkowska M, Mizerska U.   +4 more
europepmc   +1 more source

The Role of Exchange Energy in Modeling Core-Electron Binding Energies of Strongly Polar Bonds. [PDF]

Molecules
Wang F, Chong DP.
europepmc   +1 more source

Resonance-Enhanced Multiphoton Ionization Spectrum and Computational Study of 2-Cyclopenten-1-one in Its <i>T</i>₁(<i>n</i>, π*) State. [PDF]

J Phys Chem A
Narkiewicz-Jodko AW, Parsons SW, Chaurasia H, Coy SL, Drucker S.   +4 more
europepmc   +1 more source

Exploring Quantum Computing for Metal Cluster Analysis. [PDF]

J Phys Chem A
Pollard N, Hines AC, Clayborne AZ.
europepmc   +1 more source

Challenges and strategies for first-principles simulations of two-dimensional magnetic phenomena.

Nanoscale
Garrido Aldea J, Esteras DL, Roche S, Garcia JH.   +3 more
europepmc   +1 more source