Yoh Yamamoto

Electronic Structure Lab Postdoc
Software developer
Linux Technician

Office: Room 118 in Physical Science Building

Google Scholar link

Github link

Education
Ph.D. in Physics, Virginia Polytechnic Institute and State University
B.S. in Physics, University of Central Florida
Distinguished Toastmaster, Toastmasters International

Talks
FLOSIC code tutorial
Self-consistent implementation of the local interaction correction method
Orbital-SIC-SCAN | APS March Meeting 2020
Water Cluster Anions | APS March Meeting 2020

Publications
Self-interaction-corrected Kohn–Sham effective potentials using the density-consistent effective potential method
Carlos M. Diaz, Luis Basurto, Santosh Adhikari, Yoh Yamamoto, Adrienn Ruzsinszky, Tunna Baruah, and Rajendra R. Zope
J. Chem. Phys. 155, 064109 (2021)

Static dipole polarizabilities of polyacenes using self-interaction-corrected density functional approximations
S Akter, Y Yamamoto, RR Zope, T Baruah
J. Chem. Phys. 154 (11), 114305

Local self-interaction correction method with a simple scaling factor
Selim Romero, Yoh Yamamoto, Tunna Baruah, and Rajendra R. Zope
PCCP 23 (3), 2406-2418

Study of self-interaction errors in density functional predictions of dipole polarizabilities and ionization energies of water clusters using Perdew–Zunger and locally scaled self-interaction corrected methods
Sharmin Akter, Yoh Yamamoto, Carlos M. Diaz, Koblar A. Jackson, Rajendra R. Zope, and Tunna Baruah
J. Chem. Phys. 153, 164304 (2020)

Assessing the effect of regularization on the molecular properties predicted by SCAN and self-interaction corrected SCAN meta-GGA
Yoh Yamamoto, Alan Salcedo, Carlos M. Diaz, Md Shamsul Alam, Tunna Baruah, Rajendra R. Zope
Phys. Chem. Chem. Phys., 2020,22, 18060-18070

Improvements in the orbitalwise scaling down of Perdew-Zunger self-interaction correction in many-electron regions
Yoh Yamamoto, Selim Romero, Tunna Baruah, and Rajendra Zope
J. Chem. Phys. 152, 174112 (2020)

Importance of self-interaction-error removal in density functional calculations on water cluster anions
Jorge Vargas, Peter Ufondu, Tunna Baruah, Yoh Yamamoto, Koblar A. Jackson, and Rajendra R. Zope.
Phys. Chem. Chem. Phys. 22, 3789 (2020)

A step in the direction of resolving the paradox of Perdew-Zunger self-interaction correction
Rajendra R. Zope, Yoh Yamamoto, Carlos M. Diaz, Tunna Baruah, Juan E. Peralta, Koblar A. Jackson, Biswajit Santra, and John P. Perdew
J. Chem. Phys. 151, 214108 (2019)

Fermi-Löwdin orbital self-interaction correction using the strongly constrained and appropriately normed meta-GGA functional
Yoh Yamamoto, Carlos Diaz, Luis Basurto, Koblar Jackson, Tunna Baruah, and Rajendra Zope
J. Chem. Phys. 151, 154105 (2019)

Electronic structure calculation of vanadium-and scandium-based endohedral fullerenes VSc2N@C2n (2n = 70, 76, 78, 80)
Shusil Bhusal, Tunna Baruah, Yoh Yamamoto, and Rajendra R. Zope
International Journal of Quantum Chemistry 118, 24 (2018)

Electron-Vibron Coupling Effects on Electron Transport via a Single-Molecule Magnet
Alexander McCaskey, Yoh Yamamoto, Michael Warnock, Enrique Burzurí, Herre S. J. van der Zant, and Kyungwha Park
Physical Review B 91, 125419 (2015)

Franck-Condon Blockade in a Single-Molecule Transistor
Enrique Burzuri, Yoh Yamamoto, Michael Warnock, Xiaolian Zhong, Kyungwha Park, Andrea Cornia, and Herre S. J. van der Zant
Nano Letters 14, 3191 (2014)

Metastability for the Blume-Capel Model with Distribution of Magnetic Anisotropy Using Different Dynamics
Yoh Yamamoto and Kyungwha Park
Physical Review E 88, 012110 (2013)

Effect of the Size Distribution of Magnetic Nanoparticles on Metastability in Magnetization Relaxation
Yoh Yamamoto and Kyungwha Park
Physical Review B 84, 094415 (2011)

Contributed work
Electronic structure of mononuclear Cu-based molecule from density-functional theory with self-interaction correction
Anri Karanovich, Yoh Yamamoto, Koblar Alan Jackson, and Kyungwha Park
J. Chem. Phys. 155, 014106 (2021)

Exploring and enhancing the accuracy of interior-scaled Perdew–Zunger self-interaction correction
Puskar Bhattarai, Biswajit Santra, Kamal Wagle, Yoh Yamamoto, Rajendra R Zope, Adrienn Ruzsinszky, Koblar A Jackson, John P Perdew
J. Chem. Phys. 154 (9), 094105

Zn(II)-Porphyrin-Squaraine Dyads as Potential Components for Dye-Sensitized Solar Cells: A Quantum Chemical Study of Optical and Charge Transport Properties
Merlys Borges-Martinez, Nicolas Montenegro, Yoh Yamamoto, Tunna Baruah, Gloria Cardenas-Jiron
J. Phys. Chem. C 2020, 124, 24, 12968–12981

A Step in the Direction of Resolving the Paradox of Perdew-Zunger Self-interaction Correction. II. Gauge Consistency of the Energy Density at Three Levels of Approximation
Puskar Bhattarai, Kamal Wagle, Chandra Shahi, Yoh Yamamoto, Selim Romero, Biswajit Santra, Rajendra R. Zope, Juan E. Peralta, Koblar A. Jackson, John P. Perdew
J. Chem. Phys. 152, 214109 (2020)

The Effect of Self-Interaction Error on Electrostatic Dipoles Calculated Using Density Functional Theory
Alexander I. Johnson, Kushantha P. K. Withanage, Kamal Sharkas, Yoh Yamamoto, Tunna Baruah, Rajendra R. Zope, Juan E. Peralta, and Koblar A. Jackson
J. Chem. Phys. 151, 174106 (2019)

Self-interaction-free electric dipole polarizabilities for atoms and their ions using the Fermi-Löwdin self-interaction correction (FLO-SIC)
Kushantha P. K. Withanage, Sharmin Akther, Chandra Shahi, Rajendra P. Joshi, Carlos Diaz, Yoh Yamamoto, Rajendra Zope, Tunna Baruah, John P. Perdew, Juan E. Peralta, and Koblar A. Jackson
Physical Review A 100, 012505 (2019)

Stretched or noded orbital densities and self-interaction correction in density functional theory
Chandra Shahi, Puskar Bhattarai, Kamal Wagle, Biswajit Santra, Sebastian Schwallbe, Torsten Hahn, Jens Kortus, Koblar Jackson, Juan Peralta, Kai Trepte, Susi Lehtola, Niraj Nepal, Hemanadhan Myneni, Bimal Neupane, Santosh Adhikari, Adrienn Ruzsinszky, Yoh Yamamoto, Tunna Baruah, Rajendra Zope, and John Perdew
Journal of Chemical Physics 150, 174102 (2019)

Analytic Atomic Gradients in the Fermi-Löwdin orbital self-interaction correction
K. Trepte, S. Schwalbe, T. Hahn, J. Kortus, D-y. Kao, Y. Yamamoto, T. Baruah, R. R. Zope, K. P. K. Withanage, J. E. Peralta, and K. A. Jackson
Journal of Computational Chemistry 2019,40, 820–825

Fermi-Löwdin orbital self-interaction correction to magnetic exchange couplings
Rajendra P. Joshi, Kai Trepte, Kushantha P. K. Withanage, Kamal Sharkas, Yoh Yamamoto, Luis Basurto, Rajendra R. Zope, Tunna Baruah, Koblar A. Jackson, and Juan E. Peralta
The Journal of Chemical Physics 149, 164101 (2018)