Articles avec mandats d'accès public - James R. ChelikowskyEn savoir plus
Non disponibles : 12
CO tip functionalization in subatomic resolution atomic force microscopy
M Kim, JR Chelikowsky
Applied Physics Letters 107 (16), 2015
Exigences : US Department of Energy
First-principles atomic force microscopy image simulations with density embedding theory
Y Sakai, AJ Lee, JR Chelikowsky
Nano Letters 16 (5), 3242-3246, 2016
Exigences : US Department of Energy
Minority-spin polarization and surface magnetic enhancement in Heusler clusters
AT Zayak, P Entel, JR Chelikowsky
Physical Review B—Condensed Matter and Materials Physics 77 (21), 212401, 2008
Exigences : German Research Foundation
Real-Space Based Benchmark of G0W0 Calculations on GW100: Effects of Semicore Orbitals and Orbital Reordering
W Gao, JR Chelikowsky
Journal of Chemical Theory and Computation 15 (10), 5299-5307, 2019
Exigences : US Department of Energy
Space-filling curves for real-space electronic structure calculations
KH Liou, A Biller, L Kronik, JR Chelikowsky
Journal of chemical theory and computation 17 (7), 4039-4048, 2021
Exigences : US Department of Energy
Switchable Ni–Mn–Ga Heusler nanocrystals
AT Zayak, SP Beckman, ML Tiago, P Entel, JR Chelikowsky
Journal of Applied Physics 104 (7), 2008
Exigences : German Research Foundation
Doping efficiency in -type InP nanowires
LV Besteiro, L Tortajada, J Souto, LJ Gallego, JR Chelikowsky, ...
Physical Review B—Condensed Matter and Materials Physics 88 (11), 115310, 2013
Exigences : Government of Spain
Interaction range of P-dopants in Si [110] nanowires: determining the nondegenerate limit
TL Chan, AJ Lee, AWK Mok, JR Chelikowsky
Nano letters 14 (11), 6306-6313, 2014
Exigences : US Department of Energy, Research Grants Council, Hong Kong
An effective capacitance model for computing the electronic properties of charged defects in crystals
TL Chan, AJ Lee, JR Chelikowsky
Computer Physics Communications 185 (6), 1564-1569, 2014
Exigences : Research Grants Council, Hong Kong
Emergence of Functionalized Properties in Semiconductor Nanostructures
JR Chelikowsky
Handbook of Materials Modeling: Applications: Current and Emerging Materials …, 2020
Exigences : US Department of Energy
Extending the Scale with Real-Space Methods for the Electronic Structure Problem
JR Chelikowsky
Handbook of Materials Modeling: Methods: Theory and Modeling, 499-522, 2020
Exigences : US Department of Energy
Multidimensional nanoscale materials from fused quantum dots
L Tortajada, LV Besteiro, ML Tiago, LJ Gallego, JR Chelikowsky, ...
Physical Review B—Condensed Matter and Materials Physics 84 (20), 205326, 2011
Exigences : Government of Spain
Disponibles quelque part : 65
Atomically precise graphene nanoribbon heterojunctions from a single molecular precursor
GD Nguyen, HZ Tsai, AA Omrani, T Marangoni, M Wu, DJ Rizzo, ...
Nature nanotechnology 12 (11), 1077-1082, 2017
Exigences : US National Science Foundation, US Department of Energy, Fonds national …
Shellwise Mackay transformation in iron nanoclusters
G Rollmann, ME Gruner, A Hucht, R Meyer, P Entel, ML Tiago, ...
Physical review letters 99 (8), 083402, 2007
Exigences : German Research Foundation
Chebyshev-filtered subspace iteration method free of sparse diagonalization for solving the Kohn–Sham equation
Y Zhou, JR Chelikowsky, Y Saad
Journal of Computational Physics 274, 770-782, 2014
Exigences : US Department of Energy
Excitation spectra of aromatic molecules within a real-space -BSE formalism: Role of self-consistency and vertex corrections
L Hung, FH da Jornada, J Souto-Casares, JR Chelikowsky, SG Louie, ...
Physical Review B 94 (8), 085125, 2016
Exigences : US National Science Foundation, US Department of Energy
Optically Driven Magnetic Phase Transition of Monolayer RuCl3
Y Tian, W Gao, EA Henriksen, JR Chelikowsky, L Yang
Nano Letters 19 (11), 7673-7680, 2019
Exigences : US National Science Foundation, US Department of Energy, US Department of …
Magnetic properties of Fe/Cu codoped ZnO nanocrystals
R Viswanatha, D Naveh, JR Chelikowsky, L Kronik, DD Sarma
The Journal of Physical Chemistry Letters 3 (15), 2009-2014, 2012
Exigences : Department of Science & Technology, India
Roadmap on electronic structure codes in the exascale era
V Gavini, S Baroni, V Blum, DR Bowler, A Buccheri, JR Chelikowsky, ...
Modelling and Simulation in Materials Science and Engineering 31 (6), 063301, 2023
Exigences : US Department of Energy, US Department of Defense, Department of Science …
Prediction of intrinsic ferroelectricity and large piezoelectricity in monolayer arsenic chalcogenides
W Gao, JR Chelikowsky
Nano Letters 20 (11), 8346-8352, 2020
Exigences : US Department of Energy
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