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CNKI学位论文(12)
在“
Elsevier电子期刊
”中,
命中:
10
条,耗时:0.016991 秒
在所有数据库中总计命中:
12
条
1.
New insights from the relation between lattice energy and bond stretching force constant in simple ionic compounds
作者:
Savaş Kaya
a
;
savaskaya@cumhuriyet.edu.tr
;
Eduardo Chamorro
b
;
Dimitar Petrov
c
;
Cemal Kaya
a
关键词:
Bond stretching force constant
;
Lattice energy
;
Chemical hardness
;
Maximum Hardness
Principle
;
Minimum
Polarizability
Principle
刊名:Polyhedron
出版年:2017
2.
Maximum hardness and
minimum
polarizability
principle
s through lattice energies of ionic compounds
作者:
Savaş Kaya
a
;
savaskaya@cumhuriyet.edu.tr" class="auth_mail" title="E-mail the corresponding author
;
Cemal Kaya
a
;
kaya@cumhuriyet.edu.tr" class="auth_mail" title="E-mail the corresponding author
;
Nazmul Islam
b
;
nazmul.islam786@gmail.com" class="auth_mail" title="E-mail the corresponding author
关键词:
Maximum hardness
principle
;
Minimum
polarizability
principle
;
Lattice energy
;
Ionic compounds
刊名:Physica B: Physics of Condensed Matter
出版年:2016
3.
Polarizability
, hardness and electrophilicity as global descriptors for intramolecular proton transfer reaction path
作者:
Sankarlal Ash
a
;
Hasibul Beg
a
;
Prativa Mazumdar
a
;
Guillermo Salgado-Morá
;
n
b
;
Ajay Misra
a
;
ajaymsr@yahoo.co.in" class="auth_mail
关键词:
DFT
;
Proton transfer
;
Polarizability
;
Chemical hardness
;
Chemical potential
;
Electrophilicity index
刊名:Computational and Theoretical Chemistry
出版年:1 March, 2014
4.
How often is the
minimum
polarizability
principle
violated?
作者:
Shamus A. Blair
;
Ajit J. Thakkar
;
ajit@unb.ca
刊名:Chemical Physics Letters
出版年:2013
5.
Chemical reactivity parameters (HSAB) applied to magma evolution and ore formation
作者:
Jean-Louis Vigneresse
;
jean-louis.vigneresse@g2r.uhp-nancy.fr
关键词:
Silicate melt
;
Magma evolution
;
Mineralization
;
Hard&ndash
;
soft acid&ndash
;
base
刊名:Lithos
出版年:2012
6.
Structure and stability of Si
6
Li
6
: Aromaticity vs
polarizability
作者:
Juan C. Santos
;
Maryel Contreras
;
Gabriel Merino
刊名:Chemical Physics Letters
出版年:2010
7.
A theoretical study on the regioselectivity of Diels–Alder reactions using electrophilicity index
作者:
S. Noorizadeh and H. Maihami
关键词:
Diels–
;
Alder reaction
;
Electrophilicity index
;
Density functional theory
;
Maximum hardness
principle
;
Minimum
polarizability
principle
刊名:Journal of Molecular Structure: THEOCHEM
出版年:2006
8.
The maximum hardness and
minimum
polarizability
principle
s in accordance with the Bent rule
作者:
Noorizadeh
;
S.
关键词:
Density functional theory
;
Bent rule
;
Maximum hardness
principle
;
Minimum
polarizability
principle
.
刊名:Journal of Molecular Structure: THEOCHEM
出版年:2005
9.
Relative stabilities of all-metal clusters (M = Li
+
, Na
+
, K
+
, Rb
+
, Cs
+
, Cu
+
, Ag
+
, Au
+
)
作者:
Chaoyong Mang
;
Caiping Liu
;
Jun Zhou
;
Zhengui Li
;
Kechen Wu
刊名:Chemical Physics Letters
出版年:2007
10.
Theoretical study of the
trans-N
2
H
2
→cis-N
2
H
2
and
F
2
S
2
→FSSF
reactions in gas and solution phases.
作者:
Chattaraj
;
Pratim K.
;
Pé
;
rez
;
Patricia
;
Zevallos
;
Jenny
;
Toro-Labbé
;
Alejandro
关键词:
Solvent effects
;
Electrophilicity index
;
Reaction hardness profile
;
Reaction electronic chemical potential profile
;
Reaction
polarizability
profile
;
Reaction energy profile
;
HNNH
;
FSSF
刊名:Journal of Molecular Structure: THEOCHEM
出版年:2002
1
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