Results 361 to 370 of about 2,072,080 (375)

Density-functional theory

2023
Hong Jiang, Huai-Yang Sun
openaire   +1 more source

Promise and reality of post-lithium-ion batteries with high energy densities

Nature Reviews Materials, 2016
Jang Wook Choi
exaly  

Achieving high energy density and high power density with pseudocapacitive materials

Nature Reviews Materials, 2019
Christopher S Choi, David S Ashby, Danielle M Butts   +2 more
exaly  

Theory-guided design of catalytic materials using scaling relationships and reactivity descriptors

Nature Reviews Materials, 2019
Zhi-Jian Zhao, Sihang Liu, Shenjun Zha
exaly  

Functional carbon nitride materials — design strategies for electrochemical devices

Nature Reviews Materials, 2017
, Christoph Merschjann, Wolfgang Schnick
exaly  

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu.

Journal of Chemical Physics, 2010
S. Grimme, J. Antony, S. Ehrlich, H. Krieg   +3 more
semanticscholar   +1 more source

Phosphorene: from theory to applications

Nature Reviews Materials, 2016
Alexandra Carvalho, Ziao Wang, Xi Zhu
exaly  

Management of Complications of Prostate Cancer Treatment

Ca-A Cancer Journal for Clinicians, 2008
exaly  

Controlling sound with acoustic metamaterials

Nature Reviews Materials, 2016
Steven A Cummer, Johan Christensen
exaly  

Supramolecular binding thermodynamics by dispersion-corrected density functional theory.

Chemistry, 2012
S. Grimme
semanticscholar   +1 more source