Results 91 to 100 of about 1,724,768 (187)

Permanent electrostatic moments through the lens of atoms: assessing variational Hirshfeld methods. [PDF]

RSC Adv
van Zyl M, Castillo-Orellana C, Pujal L, Heidar-Zadeh F.   +3 more
europepmc   +1 more source

Density Functional Theory and Information-Theoretic Diagnostics of Quantum Phase Transitions. [PDF]

Entropy (Basel)
Romera E, Nagy Á.
europepmc   +1 more source

Gravitational form factors of the Higgs boson. [PDF]

Eur Phys J C Part Fields
Beißner P, Sun BD, Epelbaum E, Gegelia J.   +3 more
europepmc   +1 more source

Reference Depolarization Values for Polar-Organic Aggregates. [PDF]

J Chem Theory Comput
Herrero-Saboya G, Poberznik M, Salles N, Martin-Samos L.   +3 more
europepmc   +1 more source

Study of half-metallic ferromagnet RhHfVGa for spintronic and thermoelectric applications. [PDF]

Sci Rep
Zineb H, Fatima B, Fatiha B, Mohamed M, Sillanpää M, Al-Farraj S, Gupta DC.   +6 more
europepmc   +1 more source

Maintenance of polymorphism in spatially heterogeneous environments. [PDF]

Genetics
Sakamoto T, Yeaman S.
europepmc   +1 more source

Design of Bayesian Clinical Trials With Clustered Data. [PDF]

Stat Med
Hagar L, Golchi S.
europepmc   +1 more source

Accurate Prediction of Photoinduced Electron Transfer Timescales with Nonadiabatic Microcanonical Rate Theory. [PDF]

J Phys Chem Lett
Szabla R, Barboza CA.
europepmc   +1 more source

Environmental Effects via Frozen Density Embedding in Real-Time Time-Dependent Dirac-Kohn-Sham Theory: Solvation of Lead Halides. [PDF]

J Chem Theory Comput
De Santis M, Mosconi E, Pacifici L, Vallet V, Severo Pereira Gomes A, Storchi L, Belpassi L.   +6 more
europepmc   +1 more source

Chemical Information From the Ehrenfest Force Field Based on Reduced Density Matrix Functional Theory. [PDF]

J Comput Chem
Mortera-Carbonell AJ, Hernández-Trujillo J, Francisco E, Pendás AM.   +3 more
europepmc   +1 more source