Takatoshi Fujita
Takatoshi Fujita
Institute for Molecular Science, National Institutes of Natural Sciences
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Atomistic study of energy funneling in the light-harvesting complex of green sulfur bacteria
J Huh, SK Saikin, JC Brookes, S Valleau, T Fujita, A Aspuru-Guzik
Journal of the American Chemical Society 136 (5), 2048-2057, 2014
Memory-assisted exciton diffusion in the chlorosome light-harvesting antenna of green sulfur bacteria
T Fujita, JC Brookes, SK Saikin, A Aspuru-Guzik
The journal of physical chemistry letters 3 (17), 2357-2361, 2012
Fragment molecular orbital calculations on large scale systems containing heavy metal atom
T Ishikawa, Y Mochizuki, T Nakano, S Amari, H Mori, H Honda, T Fujita, ...
Chemical physics letters 427 (1-3), 159-165, 2006
Accuracy of fragmentation in ab initio calculations of hydrated sodium cation
T Fujita, K Fukuzawa, Y Mochizuki, T Nakano, S Tanaka
Chemical Physics Letters 478 (4-6), 295-300, 2009
Theoretical characterization of excitation energy transfer in chlorosome light-harvesting antennae from green sulfur bacteria
T Fujita, J Huh, SK Saikin, JC Brookes, A Aspuru-Guzik
Photosynthesis Research 120 (3), 273-289, 2014
Fragment molecular orbital calculations under periodic boundary condition
T Fujita, T Nakano, S Tanaka
Chemical Physics Letters 506 (1-3), 112-116, 2011
Ab initio Path Integral Molecular Dynamics Based on Fragment Molecular Orbital Method
T Fujita, H Watanabe, S Tanaka
Journal of the Physical Society of Japan 78 (10), 104723, 2009
Effects of salt addition on strength and dynamics of hydrophobic interactions
T Fujita, H Watanabe, S Tanaka
Chemical physics letters 434 (1-3), 42-48, 2007
Fast delocalization leads to robust long-range excitonic transfer in a large quantum chlorosome model
NPD Sawaya, J Huh, T Fujita, SK Saikin, A Aspuru-Guzik
Nano letters 15 (3), 1722-1729, 2015
Coherent Dynamics of Mixed Frenkel and Charge-Transfer Excitons in Dinaphtho[2,3-b:2′3′-f]thieno[3,2-b]-thiophene Thin Films: The Importance of Hole …
T Fujita, S Atahan-Evrenk, NPD Sawaya, A Aspuru-Guzik
The Journal of Physical Chemistry Letters 7 (7), 1374-1380, 2016
Emulation of complex open quantum systems using superconducting qubits
S Mostame, J Huh, C Kreisbeck, AJ Kerman, T Fujita, A Eisfeld, ...
Quantum Information Processing 16 (2), 44, 2017
Linear-algebraic bath transformation for simulating complex open quantum systems
J Huh, S Mostame, T Fujita, MH Yung, A Aspuru-Guzik
New Journal of Physics 16 (12), 123008, 2014
Effects of molecular motion on charge transfer/transport through DNA duplexes with and without base pair mismatch
EB Starikov, T Fujita, H Watanabe, Y Sengoku, S Tanaka, W Wenzel
Molecular Simulation 32 (9), 759-764, 2006
Development of the Fragment Molecular Orbital Method for Calculating Nonlocal Excitations in Large Molecular Systems
T Fujita, Y Mochizuki
The Journal of Physical Chemistry A 122 (15), 3886-3898, 2018
Assessing the accuracy of integral equation theories for nano-sized hydrophobic solutes in water
T Fujita, T Yamamoto
The Journal of Chemical Physics 147 (1), 014110, 2017
Relating stacking structures and charge transport in crystal polymorphs of the pyrrole-based π-conjugated molecule
T Fujita, Y Haketa, H Maeda, T Yamamoto
Organic Electronics 49, 53-63, 2017
Ab initio path integral Monte Carlo simulations for water trimer with electron correlation effects
T Fujita, S Tanaka, T Fujiwara, MA Kusa, Y Mochizuki, M Shiga
Computational and Theoretical Chemistry 997, 7-13, 2012
Numerical aspect of large-scale electronic state calculation for flexible device material
T Hoshi, H Imachi, A Kuwata, K Kakuda, T Fujita, H Matsui
Japan Journal of Industrial and Applied Mathematics, 2019
Thousand-atom ab initio calculations of excited states at organic/organic interfaces: toward first-principles investigations of charge photogeneration
T Fujita, MK Alam, T Hoshi
Physical Chemistry Chemical Physics 20 (41), 26443-26452, 2018
Development of the fragment-based COHSEX method for large and complex molecular systems
T Fujita, Y Noguchi
Physical Review B 98, 205140, 2018
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Artículos 1–20