Dmitrij Rappoport
机构: University of California, Irvine
每年引用次数
引用次数
引用: 5,221
H-指数: 28
I10-指数 : 39
出版物: 87
Anomalously Rapid Tunneling: Charge Transport across Self-Assembled Monolayers of Oligo(ethylene glycol)
Mostafa Baghbanzadeh , Carleen M. Bowers , Dmitrij Rappoport , Tomasz Żaba
Journal of the American Chemical Society 139 ( 22) 7624 -7631
21
2017
TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations
Sree Ganesh Balasubramani , Guo P. Chen , Sonia Coriani , Michael Diedenhofen
The Journal of Chemical Physics 152 ( 18) 184107
455
2020
Temperature-Dependent Conformations of a Membrane Supported Zinc Porphyrin Tweezer by 2D Fluorescence Spectroscopy
Julia R. Widom , Wonbae Lee , Alejandro Perdomo-Ortiz , Dmitrij Rappoport
Journal of Physical Chemistry A 117 ( 29) 6171 -6184
31
2013
Excitonics: A Set of Gates for Molecular Exciton Processing and Signaling
Nicolas P. D. Sawaya , Dmitrij Rappoport , Daniel P. Tabor , Alán Aspuru-Guzik
ACS Nano 12 ( 7) 6410 -6420
6
2018
Excitonics: A universal set of binary gates for molecular exciton processing and signaling
Nicolas Sawaya , Dmitrij Rappoport , Daniel Tabor , Alan Aspuru-Guzik
ChemRxiv
2017
Uncertainty of Prebiotic Scenarios: The Case of the Non-Enzymatic Reverse Tricarboxylic Acid Cycle
Dmitry Yu Zubarev , Dmitrij Rappoport , Alán Aspuru-Guzik
Scientific Reports 5 ( 1) 8009 -8009
30
2015
Electronic structure calculations in arbitrary electrostatic environments.
Mark A. Watson , Dmitrij Rappoport , Elizabeth M. Y. Lee , Roberto Olivares-Amaya
Journal of Chemical Physics 136 ( 2) 024101 -024101
17
2012
Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules
Dmitrij Rappoport , Filipp Furche
Journal of Chemical Physics 122 ( 6) 064105 -064105
110
2005
Introducing Ionic and/or Hydrogen Bonds into the SAM//Ga 2 O 3 Top- Interface of Ag TS /S(CH 2 ) n T//Ga 2 O 3 /EGaIn Junctions
Carleen M. Bowers , Kung-Ching Liao , Hyo Jae Yoon , Dmitrij Rappoport
Nano Letters 14 ( 6) 3521 -3526
49
2014
Density Functional Methods for Excited States: Equilibrium Structure and Electronic Spectra
Filipp Furche , Dmitrij Rappoport
Theoretical and Computational Chemistry 16 93 -128
180
2005
Lagrangian approach to molecular vibrational Raman intensities using time-dependent hybrid density functional theory
Dmitrij Rappoport , Filipp Furche
The Journal of Chemical Physics 126 ( 20) 201104 -201104
65
2007
Charge Transport through Self-Assembled Monolayers of Monoterpenoids
Brian J. Cafferty , Li Yuan , Mostafa Baghbanzadeh , Dmitrij Rappoport
Angewandte Chemie 58 ( 24) 8097 -8102
4
2019
Theoretische Chemie 2008
Dmitrij Rappoport , Filipp Furche
Nachrichten aus der Chemie 57 ( 3) 305 -311
4
2009
Synthesis and Stereochemical Properties of Chiral Square Complexes of Iron(II)
Thomas Bark , Alexander von Zelewsky , Dmitrij Rappoport , Markus Neuburger
Chemistry: A European Journal 10 ( 19) 4839 -4845
26
2004
Complex Chemical Reaction Networks from Heuristics-Aided Quantum Chemistry
Dmitrij Rappoport , Cooper J. Galvin , Dmitry Yu. Zubarev , Alán Aspuru-Guzik
Journal of Chemical Theory and Computation 10 ( 3) 897 -907
120
2014
Basis-Set Quality and Basis-Set Bias in Molecular Property Calculations
Dmitrij Rappoport
ChemPhysChem 12 ( 17) 3404 -3413
5
2011
Can Mixed-Metal Surfaces Provide an Additional Enhancement to SERS?
Roberto Olivares-Amaya , Dmitrij Rappoport , Philip A Munoz , Paul Peng
Journal of Physical Chemistry C 116 ( 29) 15568 -15575
9
2012
Reaction Networks and the Metric Structure of Chemical Space(s).
Dmitrij Rappoport
Journal of Physical Chemistry A 123 ( 13) 2610 -2620
2
2019
Photoinduced intramolecular charge transfer in 4-(dimethyl)aminobenzonitrile - a theoretical perspective
Dmitrij Rappoport , Filipp Furche
Journal of the American Chemical Society 126 ( 4) 1277 -1284
188
2004
Charge Tunneling along Short Oligoglycine Chains
Mostafa Baghbanzadeh , Carleen M. Bowers , Dmitrij Rappoport , Tomasz Żaba
Angewandte Chemie 54 ( 49) 14743 -14747
17
2015