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Zeitschriftenartikel (3)

2019

Zeitschriftenartikel

Stochastic Schrödinger Equations and Conditional States: A General Non-Markovian Quantum Electron Transport Simulator for THz Electronics

D. Pandey, E. Colomés, G. Albareda Piquer, X. Oriols

Entropy 21 (12), 1148 (2019)

MPG.PuRe

DOI

publisher-version

Zeitschriftenartikel

Interplay between the Gentlest Ascent Dynamics Method and Conjugate Directions to Locate Transition States

J. M. Bofill, J. Ribas-Ariño, R. Valero, G. Albareda Piquer, I. de P. R. Moreira, W. Quapp

Journal of Chemical Theory and Computation 15 (10), 5426–5439 (2019)

MPG.PuRe

DOI

publisher-version

supplementary-material

Zeitschriftenartikel

Nonadiabatic quantum dynamics without potential energy surfaces

G. Albareda Piquer, A. Kelly, A. Rubio

Physical Review Materials 3 (2), 023803 (2019)

MPG.PuRe

DOI

publisher-version

supplementary-material

Forschungspapier (4)

2019

Forschungspapier

Unmeasured Bohmian properties and their measurement through local-in-position weak values for assessing non-contextual quantum dynamics

D. Pandey, R. Sampaio, T. Ala-Nissila, G. Albareda Piquer, X. Oriols

(2019)

MPG.PuRe

pre-print

Forschungspapier

Biradical Formation by Deprotonation in Thiazole-Derivatives: The Hidden Nature of Dasatinib

C. Heras, D. Reta, R. Valero, G. Albareda Piquer, N. Chilton, A. Fielding, I. P. R. de Moreira, J. M. Bofill, F. L. Calahorra

(2019)

MPG.PuRe

DOI

pre-print

Forschungspapier

Proposal for a clumsiness-free test of macroscopic realism

D. Pandey, X. Oriols, G. Albareda Piquer

(2019)

MPG.PuRe

pre-print

Forschungspapier

Quantum equilibration of a model system Porphine

G. Albareda Piquer, A. Riera, M. Gonzalez, J. M. Bofill, I. P. R. de Moreira, R. Valero, I. Tavernelli

(2019)

MPG.PuRe

pre-print