Panchapakesan Ganesh Section Head, Theory & Computation Section, Center for Nanophase Materials Sciences Contact 865.574.1999 | GANESHP@ORNL.GOV All Publications Thickness and strain dependence of piezoelectric coefficient in BaTiO3 thin films Understanding Beam-Induced Electronic Excitations in Materials Tunable quadruple-well ferroelectric van der Waals crystals Simulation of 24,000 Electron Dynamics: Real-Time Time-Dependent Density Functional Theory (TDDFT) with the Real-Space Multigrids (RMG) Shaping the Future of Self-Driving Autonomous Laboratories Workshop... First-principles study of the magneto-Raman effect in van der Waals layered magnets Visualizing the Amorphous to Crystalline Transition of Bismuth Selenide in the TEM Multinary light absorbing semiconductor nanocrystals with diversified electronic and optical properties First-Principles Simulation of Beam-Induced Processes Underlying Atomic Manipulation in Electron Microscopes JARVIS-Leaderboard: a large scale benchmark of materials design methods Enhanced Twist-Averaging Technique for Magnetic Metals: Applications Using Quantum Monte Carlo A new generation of effective core potentials: Selected lanthanides and heavy elements DFT+U and quantum Monte Carlo study of electronic and optical properties of AgNiO2 and AgNi1−xCoxO2 delafossite Digital twins and deep learning segmentation of defects in monolayer MX2 phases... Defects go green: using defects in nanomaterials for renewable energy and environmental sustainability Stacking Faults and Topological Properties in MnBi2Te4: Reconciling Gapped and Gapless States Scale-free switching of polarization in the layered ferroelectric material CuInP2S6 The role of electron correlations in the electronic structure of putative Chern magnet TbMn6Sn6... Emergent Magnetism with Continuous Control in the Ultrahigh-Conductivity Layered Oxide PdCoO2 A Graph Dynamical neural network approach for decoding dynamical states in ferroelectrics. Extraction of interaction parameters from specular neutron reflectivity in thin films of diblock copolymers: an “inverse problem” Robust Copper-Based Nanosponge Architecture Decorated by Ruthenium with Enhanced Electrocatalytic Performance for Ambient Nitrogen Reduction to Ammonia The Atomic Drill Bit: Precision Controlled Atomic Fabrication of 2D Materials Phase Transition Dynamics in a Complex Oxide Heterostructure Extracting Inelastic Scattering Cross Sections for Finite and Aperiodic Materials from Electronic Dynamics Simulations Pagination Current page 1 Page 2 Page 3 … Next page ›ĺ Last page Last » Key Links Curriculum Vitae Organizations Physical Sciences Directorate User Facilities Center for Nanophase Materials Sciences Theory and Computation Section
