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Nano Letters|November 2, 2020
Prediction of Intrinsic Ferroelectricity and Large Piezoelectricity in Monolayer Arsenic ChalcogenidesWeiwei Gao, James R ChelikowskyJournal of Chemical Theory and Computation|February 20, 2020
Accelerating Time-Dependent Density Functional Theory and GW Calculations for Molecules and Nanoclusters with Symmetry Adapted Interpolative Separable Density FittingWeiwei Gao, James R ChelikowskyJournal of Chemical Theory and Computation|August 20, 2019
Real-Space Based Benchmark of G0W0 Calculations on GW100: Effects of Semicore Orbitals and Orbital ReorderingWeiwei Gao, James R ChelikowskyJournal of Chemical Theory and Computation|November 7, 2018
Accuracy of Partial Core Corrections Using Fourier Transforms in Pseudopotential-Density Functional TheoryWeiwei Gao, James R ChelikowskyPhysical Chemistry Chemical Physics : PCCP|July 7, 2018
The stability, electronic structure, and optical absorption of boron-nitride diamondoids predicted with first-principles calculationsWeiwei Gao, Linda Hung, Serdar Ogut, et al.Physical Review Letters|April 5, 2024
Efficient Full-Frequency GW Calculations Using a Lanczos MethodWeiwei Gao, Zhao Tang, Jijun Zhao, et al.Nano Letters|October 23, 2019
Optically Driven Magnetic Phase Transition of Monolayer RuCl3Yingzhen Tian, Weiwei Gao, Erik A Henriksen, et al.Journal of Chemical Theory and Computation|May 27, 2026
Real-Space Stochastic GW Calculations Benchmark on GW20Ishita Shitut, Weiwei Gao, James R Chelikowsky, et al.Physical Review Letters|December 20, 2003
Charge state dependent Jahn-Teller distortions of the e-center defect in crystalline SiSerdar Oğüt, James R ChelikowskySmall (Weinheim an Der Bergstrasse, Germany)|October 1, 2021
Atomic Fingerprinting of Heteroatoms Using Noncontact Atomic Force MicroscopyDingxin Fan, James R ChelikowskyPageof 48