David Manolopoulos

Cituota

	Visi	Nuo 2020
Šaltiniai	22646	6058
h-rodyklė	77	41
i10-rodyklė	151	98

1300

650

325

975

199019911992199319941995199619971998199920002001200220032004200520062007200820092010201120122013201420152016201720182019202020212022202320242025101 113 222 314 268 263 296 358 361 388 383 383 410 412 580 477 548 522 615 600 555 724 685 834 875 932 1029 937 1159 1045 1145 1183 1121 1148 1242 216

Viešas pasiekiamumas

Peržiūrėti viską

37 straipsniai

6 straipsniai

pasiekiami

nepasiekiami

Pagal finansavimo įpareigojimus

Bendraautoriai

Michele CeriottiAssociate Professor at EPFL, Institute of MaterialsPatvirtintas el. paštas epfl.ch
Scott HabershonProfessor, Department of Chemistry, University of Warwick, UKPatvirtintas el. paštas warwick.ac.uk
Thomas MarklandAssociate Professor of Chemistry, Stanford UniversityPatvirtintas el. paštas stanford.edu
Thomas MillerCalifornia Institute of TechnologyPatvirtintas el. paštas caltech.edu
Jesus F. CastilloProfessor of Physical Chemistry, Universidad Complutense de MadridPatvirtintas el. paštas ucm.es
Joseph E. LawrenceNew York UniversityPatvirtintas el. paštas nyu.edu
Thomas FayAix-Marseille UniversitéPatvirtintas el. paštas univ-amu.fr
Lachlan P LindoyNational Physical LaboratoryPatvirtintas el. paštas npl.co.uk
Alan M. LewisLecturer (Assistant Professor), University of YorkPatvirtintas el. paštas york.ac.uk
Rosana Collepardo-GuevaraProfessor of Computational and Molecular Biophysics, U of CambridgePatvirtintas el. paštas cam.ac.uk
Tomás González-LezanaInstituto de Física Fundamental - CSICPatvirtintas el. paštas csic.es
David M WilkinsQueen's University BelfastPatvirtintas el. paštas qub.ac.uk
Mariana RossiHead of Independent Lise Meitner Group, MPI for Structure and Dynamics of Matter, HamburgPatvirtintas el. paštas mpsd.mpg.de
Johan E. RunesonResearch Associate, University of FreiburgPatvirtintas el. paštas physik.uni-freiburg.de
Annina Z LieberherrPhD student, University of OxfordPatvirtintas el. paštas chem.ox.ac.uk
Yury Suleymanov

Stebėti

David Manolopoulos

University of Oxford

Patvirtintas el. paštas chem.ox.ac.uk - Pagrindinis puslapis

Theoretical Chemistry


Pavadinimas Rūšiuoti pagal šaltinius Rūšiuoti pagal metus Rūšiuoti pagal pavadinimą	Cituota Cituota	Metai
An atlas of fullerenes PW Fowler, DE Manolopoulos Courier Corporation, 2007	2233	2007
Quantum statistics and classical mechanics: Real time correlation functions from ring polymer molecular dynamics IR Craig, DE Manolopoulos The Journal of chemical physics 121 (8), 3368-3373, 2004	930	2004
An improved log derivative method for inelastic scattering DE Manolopoulos The Journal of chemical physics 85 (11), 6425-6429, 1986	795	1986
Ring-polymer molecular dynamics: Quantum effects in chemical dynamics from classical trajectories in an extended phase space S Habershon, DE Manolopoulos, TE Markland, TF Miller III Annual review of physical chemistry 64 (1), 387-413, 2013	750	2013
Competing quantum effects in the dynamics of a flexible water model S Habershon, TE Markland, DE Manolopoulos The journal of chemical physics 131 (2), 024501, 2009	598	2009
Theoretical studies of the fullerenes: C34 to C70 DE Manolopoulos, JC May, SE Down Chemical physics letters 181 (2), 105-111, 1991	549	1991
ABC: a quantum reactive scattering program D Skouteris, JF Castillo, DE Manolopoulos Computer Physics Communications 133 (1), 128-135, 2000	543	2000
A stable linear reference potential algorithm for solution of the quantum close‐coupled equations in molecular scattering theory MH Alexander, DE Manolopoulos The Journal of chemical physics 86 (4), 2044-2050, 1987	458	1987
Chemical reaction rates from ring polymer molecular dynamics IR Craig, DE Manolopoulos The Journal of chemical physics 122 (8), 2005	448	2005
Efficient stochastic thermostatting of path integral molecular dynamics M Ceriotti, M Parrinello, TE Markland, DE Manolopoulos The Journal of chemical physics 133 (12), 2010	420	2010
Molecular graphs, point groups, and fullerenes DE Manolopoulos, PW Fowler The Journal of chemical physics 96 (10), 7603-7614, 1992	395	1992
i-PI 2.0: A universal force engine for advanced molecular simulations V Kapil, M Rossi, O Marsalek, R Petraglia, Y Litman, T Spura, B Cheng, ... Computer Physics Communications 236, 214-223, 2019	359	2019
A refined ring polymer molecular dynamics theory of chemical reaction rates IR Craig, DE Manolopoulos The Journal of chemical physics 123 (3), 2005	357	2005
Resonance-mediated chemical reaction: F+HD → HF+D RT Skodje, D Skouteris, DE Manolopoulos, SH Lee, F Dong, K Liu Physical review letters 85 (6), 1206, 2000	330	2000
van der Waals Interactions in the Cl+HD Reaction D Skouteris, DE Manolopoulos, W Bian, HJ Werner, LH Lai, K Liu Science 286 (5445), 1713-1716, 1999	326	1999
Derivation and reflection properties of a transmission-free absorbing potential DE Manolopoulos The Journal of chemical physics 117 (21), 9552-9559, 2002	323	2002
i-PI: A Python interface for ab initio path integral molecular dynamics simulations M Ceriotti, J More, DE Manolopoulos Computer Physics Communications 185 (3), 1019-1026, 2014	315	2014
An investigation of the F+H2 reaction based on a full ab initio description of the open-shell character of the F(2P) atom MH Alexander, DE Manolopoulos, HJ Werner The Journal of Chemical Physics 113, 11084, 2000	314	2000
The transition state of the F+H2 reaction DE Manolopoulos, K Stark, HJ Werner, DW Arnold, SE Bradforth, ... Science-AAAS-Weekly Paper Edition-including Guide to Scientific Information …, 1993	300	1993
Quantum scattering via the log derivative version of the Kohn variational principle DE Manolopoulos, RE Wyatt Chemical physics letters 152 (1), 23-32, 1988	286	1988

Sistema negali atlikti operacijos. Bandykite vėliau dar kartą.

Straipsniai 1–20

Šaltinių per metus

Dubliuoti šaltiniai

Sujungti šaltiniai

Pridėti bendraautoriusBendraautoriai

Stebėti

Cituota

Bendraautoriai