Rajendra P. Joshi
Rajendra P. Joshi
Pacific Northwest National Laboratory
Email verificata su cmich.edu - Home page
Titolo
Citata da
Citata da
Anno
Band gap tunning in BN-doped graphene systems with high carrier mobility
TP Kaloni, RP Joshi, NP Adhikari, U Schwingenschlgl
Applied Physics Letters 104 (7), 073116, 2014
642014
Hexagonal BC3: A Robust Electrode Material for Li, Na, and K Ion Batteries
RP Joshi, B Ozdemir, V Barone, JE Peralta
The journal of physical chemistry letters 6 (14), 2728-2732, 2015
542015
Fermi-Lwdin orbital self-interaction correction to magnetic exchange couplings
RP Joshi, K Trepte, KPK Withanage, K Sharkas, Y Yamamoto, L Basurto, ...
The Journal of chemical physics 149 (16), 164101, 2018
192018
Shrinking Self-Interaction Errors with the Fermi–Löwdin Orbital Self-Interaction-Corrected Density Functional Approximation
K Sharkas, L Li, K Trepte, KPK Withanage, RP Joshi, RR Zope, T Baruah, ...
The Journal of Physical Chemistry A 122 (48), 9307-9315, 2018
182018
Self-interaction-free electric dipole polarizabilities for atoms and their ions using the Fermi-Lwdin self-interaction correction
KPK Withanage, S Akter, C Shahi, RP Joshi, C Diaz, Y Yamamoto, ...
Physical Review A 100 (1), 012505, 2019
152019
Magnetic exchange couplings in heterodinuclear complexes based on differential local spin rotations
RP Joshi, JJ Phillips, JE Peralta
Journal of Chemical Theory and Computation 12 (4), 1728-1734, 2016
132016
Machine learning the voltage of electrode materials in metal-ion batteries
RP Joshi, J Eickholt, L Li, M Fornari, V Barone, JE Peralta
ACS applied materials & interfaces 11 (20), 18494-18503, 2019
122019
Towards efficient density functional theory calculations without self-interaction: The Fermi-Lwdin orbital self-interaction correction
KA Jackson, JE Peralta, RP Joshi, KP Withanage, K Trepte, K Sharkas, ...
Journal of Physics: Conference Series 1290 (1), 012002, 2019
82019
Local Noncollinear Spin Analysis
BA Abate, RP Joshi, JE Peralta
Journal of chemical theory and computation 13 (12), 6101-6107, 2017
22017
Revealing the Formation Energy-Exfoliation Energy-Structure Correlation of MAB Phases using Machine Learning and DFT
EMD Siriwardane, R Joshi, N Kumar, D Cakir
ACS Applied Materials & Interfaces, 2020
12020
Molecular spin frustration in mixed-chelate Fe5 and Fe6 oxo clusters with high ground state spin values
AP Singh, RP Joshi, KA Abboud, JE Peralta, G Christou
Polyhedron 176, 114182, 2020
12020
Accuracy of density functional theory methods for the calculation of magnetic exchange couplings in binuclear iron (III) complexes
RP Joshi, JJ Phillips, KJ Mitchell, G Christou, KA Jackson, JE Peralta
Polyhedron 176, 114194, 2020
2020
Improving the Calculations of Magnetic Exchange Couplings in Single Molecule Magnets
RP Joshi
Central Michigan University, 2019
2019
Self-Interaction Error free Magnetic Exchange Couplings: LSDA vs PBE vs SCAN.
R Joshi, K Jackson, J Peralta
APS 2019, G70. 321, 2019
2019
Machine Learning the Energy Storage Materials
R Joshi, V Barone, J Eickholt, J Peralta
APS 2019, F47. 004, 2019
2019
Improving the prediction of magnetic interactions from DFT methods: Non-collinear magnetization and self-interaction
J Peralta, R Joshi, K Trepte, K Jackson
APS 2019, H31. 002, 2019
2019
Magnetic Exchange Couplings from Fermi-Lwdin Orbital Self-Interaction Corrected Density Functional Approximations
R Joshi, K Withanage, K Trepte, K Jackson, J Peralta
APS 2018, P18. 012, 2018
2018
BC3 as electrode for Mg ion batteries
R Joshi, V Barone, J Peralta
APS 2017, G1. 082, 2017
2017
Magnetic Exchange Couplings from Local Spin Analysis
R Joshi, BA Abate, J Peralta
APS 2017, M1. 343, 2017
2017
Hexagonal BC3 as a Robust Electrode Material for Li, Na, and K Ion Batteries
R Joshi, B Ozdemir, J Peralta, V Barone
APS 2016, R52. 012, 2016
2016
Il sistema al momento non pu eseguire l'operazione. Riprova pi tardi.
Articoli 1–20