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Michele Pavanello
Michele Pavanello
Professor, Rutgers University-Newark
Email verificata su rutgers.edu - Home page
Titolo
Citata da
Citata da
Anno
ADF2017, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands
EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ...
URL: http://www. scm. com, 2014
4362014
ADF2017
EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ...
SCM, Theoretical Chemistry, 2017
286*2017
ADF2017, SCM, theoretical chemistry
EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ...
Vrije Universiteit, 2017
2012017
Self-assembled organic nanowires for high power density lithium ion batteries
C Luo, R Huang, R Kevorkyants, M Pavanello, H He, C Wang
Nano letters 14 (3), 1596-1602, 2014
1912014
Born–Oppenheimer and non-Born–Oppenheimer, atomic and molecular calculations with explicitly correlated Gaussians
S Bubin, M Pavanello, WC Tung, KL Sharkey, L Adamowicz
Chemical reviews 113 (1), 36-79, 2013
1402013
SCM, theoretical chemistry
EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ...
ADF2012 1, 2013
992013
Precision measurements and computations of transition energies in rotationally cold triatomic hydrogen ions up to the midvisible spectral range
M Pavanello, L Adamowicz, A Alijah, NF Zobov, II Mizus, OL Polyansky, ...
Physical review letters 108 (2), 023002, 2012
992012
Modelling charge transfer reactions with the frozen density embedding formalism
M Pavanello, J Neugebauer
The Journal of chemical physics 135 (23), 234103, 2011
972011
Fullerene as an electron buffer: charge transfer in Li@ C60
M Pavanello, AF Jalbout, B Trzaskowski, L Adamowicz
Chemical physics letters 442 (4-6), 339-343, 2007
902007
Theoretical Chemistry
EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ...
Vrije Universiteit, Amsterdam, The Netherlands https://www. scm. com, 2014
882014
Calibration-quality adiabatic potential energy surfaces for and its isotopologues
M Pavanello, L Adamowicz, A Alijah, NF Zobov, II Mizus, OL Polyansky, ...
The Journal of Chemical Physics 136 (18), 184303, 2012
782012
Subsystem density-functional theory as an effective tool for modeling ground and excited states, their dynamics and many-body interactions
A Krishtal, D Sinha, A Genova, M Pavanello
Journal of Physics: Condensed Matter 27 (18), 183202, 2015
762015
An accurate and linear-scaling method for calculating charge-transfer excitation energies and diabatic couplings
M Pavanello, T Van Voorhis, L Visscher, J Neugebauer
The Journal of chemical physics 138 (5), 054101, 2013
712013
ADF2014. SCM. Theoretical Chemistry. Vrije Universiteit. Amsterdam
EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ...
61*2014
Very accurate potential energy curve of the LiH molecule
WC Tung, M Pavanello, L Adamowicz
The Journal of chemical physics 134 (6), 064117, 2011
612011
Adiabatic energy loss in hyperthermal H atom collisions with Cu and Au: A basis for testing the importance of nonadiabatic energy loss
M Pavanello, DJ Auerbach, AM Wodtke, M Blanco-Rey, M Alducin, ...
The Journal of Physical Chemistry Letters 4 (21), 3735-3740, 2013
562013
Ab initio molecular dynamics calculations on scattering of hyperthermal H atoms from Cu(111) and Au(111)
GJ Kroes, M Pavanello, M Blanco-Rey, M Alducin, DJ Auerbach
The Journal of Chemical Physics 141 (5), 054705, 2014
552014
On the subsystem formulation of linear-response time-dependent DFT
M Pavanello
The Journal of Chemical Physics 138 (20), 204118, 2013
552013
High-accuracy calculations of the ground, , and the , , and excited states of
M Pavanello, L Adamowicz
The Journal of chemical physics 130 (3), 034104, 2009
522009
Nonlocal kinetic energy functionals by functional integration
W Mi, A Genova, M Pavanello
The Journal of Chemical Physics 148 (18), 184107, 2018
512018
Il sistema al momento non puň eseguire l'operazione. Riprova piů tardi.
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