设为首页
收藏本站
网站地图
|
English
|
公务邮箱
About the library
Background
History
Leadership
Organization
Readers' Guide
Opening Hours
Collections
Help Via Email
Publications
Electronic Information Resources
常用资源
电子图书
期刊论文
学位会议
外文资源
特色专题
内部出版物
GSW全文库(51)
Springer电子图书(14)
CNKI学位论文(5058)
知网期刊论文(3209)
馆藏书目(1)
CNKI会议论文(26)
CNKI期刊论文0611(9)
在“
SpringerLink电子期刊
”中,
命中:
3,099
条,耗时:小于0.01 秒
在所有数据库中总计命中:
8,368
条
1.
Structure of alcohol cluster ions in the gas phase, according to spectrometry and
ab
initio
calculations
作者:
A. V. Krisilov
;
E. V. Lantsuzskaya
;
A. M. Levina
关键词:
ionic structure
;
ab
initio
computation
;
alcohols
;
clusters
;
ion mobility spectrometry
;
scattering cross section
刊名:Russian Journal of Physical Chemistry A
出版年:2017
2.
Ab
initio
study of the electronic, optical and thermodynamic properties of the ternary phosphides Li
Ae
P (
Ae
= Sr, Ba)
作者:
A. Benahmed
;
A. Bouhemadou
;
R. Khenata
;
S. Bin-Omran
关键词:
Ternary phosphides
;
Ab
initio
calculations
;
Electronic structure
;
Optical properties
;
Thermal effect
刊名:Indian Journal of Physics
出版年:2017
3.
Diamond’s third-order elastic constants:
ab
initio
calculations
and experimental investigation
作者:
Arsenii V. Telichko
;
Sergey V. Erohin
;
Gennady M. Kvashnin…
刊名:Journal of Materials Science
出版年:2017
4.
Network-Forming Nanoclusters in Binary As–S/Se Glasses: From
Ab
Initio
Quantum Chemical Modeling to Experimental Evidences
作者:
M. Hyla
关键词:
Chalcogenide glasses
;
Nanocluster
;
Reversibility window
;
Ab
initio
calculation
刊名:Nanoscale Research Letters
出版年:2017
5.
Electronic, optical and magnetic properties of TM (Cr and Fe) doped Titania TiO
2
:
Ab
initio
calculations
, mean field approximation and Monte Carlo simulation
作者:
El Mehdi Salmani
;
Ayoub Laghrissi
;
Rachida Lamouri…
关键词:
First
;
principles calculation
;
Self
;
interaction correction
;
TiO2
;
Monte Carlo approach
刊名:Optical and Quantum Electronics
出版年:2017
6.
First-Principles Study of Substitution of Cu and Au for Ni in Ni
3
Sn
2
作者:
Yali Tian
;
Ping Wu
;
Zhengxiong Lu
关键词:
Intermetallic compounds
;
ab
initio
calculations
;
mechanical properties
;
brittleness and ductility
刊名:Journal of Electronic Materials
出版年:2017
7.
Numerical Exact
Ab
Initio
Four-Nucleon Scattering
Calculations
: from Dream to Reality
作者:
A. C. Fonseca
;
A. Deltuva
刊名:Few-Body Systems
出版年:2017
8.
Ab
initio
computational study of 1-methyl-4-silatranone and attempts at its conventional synthesis
作者:
Jessica P. Morgan
;
Holly M. Weaver-Guevara
;
Ryan W. Fitzgerald…
关键词:
Silatrane
;
Lactam
;
Amide
;
Resonance energy
刊名:Structural Chemistry
出版年:2017
9.
Double-layer capacitance for a charged surface
作者:
Robert Warmbier
;
Nkosinathi Malaza
;
Alexander Quandt
关键词:
Supercapacitors
;
Ab
initio
simulations
;
Effective screening medium
;
Capacitance
刊名:Ionics
出版年:2017
10.
Scale Bridging Simulations of Large Elastic Deformations and Bainitic Transformations
关键词:
Multi phase field
;
Bainite transformation
;
Phase field crystal
;
ab
initio
Calculations
;
Nonlinear elasticity
;
GPU implementation
刊名:Lecture Notes in Computer Science
出版年:2017
1
2
3
4
5
6
7
8
9
按检索点细分(3099)
题名(315)
关键词(757)
文摘(2104)
NGLC 2004-2010.National Geological Library of China All Rights Reserved.
Add:29 Xueyuan Rd,Haidian District,Beijing,PRC. Mail Add: 8324 mailbox 100083
For exchange or info please contact us via
email
.