Search Result "GGA"

HSP-Dependent Protection Against Gastrointestinal Diseases

Journal: Current Pharmaceutical Design
Volume: 16 Issue: 1 Year: 2010 Page: 1190-1196
Author(s): Tohru Mizushima

Magnetism in CdV2O4 from First Principles

Journal: Current Physical Chemistry
Volume: 3 Issue: 4 Year: 2013 Page: 485-492
Author(s): Yu-Hua Zhang,Jian Meng,Carlton A. Taft

First Principle Study of Oxygen Diffusion on Uranium Nitride UN (001) Surface with Uranium or Nitrogen Vacancies

Journal: Micro and Nanosystems
Volume: 7 Issue: 2 Year: 2015 Page: 124-130
Author(s): T. Zergoug,S.E.H. Abaidia,A. Nedjar

Recent Developments on the Studies of Human Memapsin 2 (β-Secretase)

Journal: Current Alzheimer Research
Volume: 2 Issue: 2 Year: 2005 Page: 261-264
Author(s): Jordan Tang, Xiangyang He, Xianping Huang, Lin Hong

Current State-of-the-art for Quantum Mechanics-based Methods in Drug Design

Ebook: Young People’s Visions of the World

Volume: 1 Year: 2010
Author(s): Carlton Anthony Taft,Carlos Henrique Tomich de Paula da Silva
Doi: 10.2174/97816080512741100101
Research Article

Electronic and Thermoelectric Properties of SrTiO3

Journal: Current Smart Materials (Discontinued)
Volume: 2 Issue: 1 Year: 2017 Page: 73-79
Author(s): Kaliaperumal Shanmugapriya,Balan Palanivel,Ramaswamy Murugan

The Essence of Density Functional Theory

Ebook: Turbulent Flow and Boundary Layer Theory: Selected Topics and Solved Problems

Volume: 1 Year: 2021
Author(s): Ambrish Kumar Srivastava,Neeraj Misra
Doi: 10.2174/97898149983691210101
Research Article

Palladium(II) Catalyzed Oxidation of Glycine by Ferricyanide in Acid Medium: Kinetics and Mechanism

Journal: Current Physical Chemistry
Volume: 7 Issue: 1 Year: 2017 Page: 63-70
Author(s): Krishna K. Yerneni,Kishore Cholkar,Mridula Guin,Ananth N. Nayak,S. Ananda,Netkal M. Made Gowda

open access plus

Optimizing the Structure of Tetracyanoplatinate (II): A Comparison of Relativistic Density Functional Theory Methods

Journal: Current Inorganic Chemistry (Discontinued)
Volume: 3 Issue: 3 Year: 2013 Page: 213-219
Author(s): Asmus O. Dohn,Klaus B. Moller,Stephan P. A. Sauer

Novel MicroRNAs and Microsatellite-like Small RNAs in Sexual and Apomictic Boechera Species

Journal: MicroRNA
Volume: 2 Issue: 1 Year: 2013 Page: 46-63
Author(s): Samuel Amiteye, Jose M. Corral, Heiko Vogel, Markus Kuhlmann, Michael F. Mette, Timothy F. Sharbel

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