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Keyword [ab-initio]
Result: 121 - 140 | Page: 7 of 10
121.
Theoretical Study Of Multifurcated Bent Hydrogen Bonds And Intermolecular Interaction
122.
AB Initio Molecular Dynamics Study Of The Hydrogen Bonding In Liquid Water
123.
Theoretical Study Of SrTiO
3
Ferroelectric Thin Films Initial Homoepitaxial Growth
124.
Ab Initio Study Of The Organic Nonlinear Optical Material
125.
The Theoretical Study On The Structures And Reaction Of GeR
1
R
2
MX Germylenoid
126.
Basing On Ab Initio Calculation Results To Improve The Potential Calculation Of Ti-Si-N
127.
A Computational Study On The Mechanism For The Interaction Of Cytosine With Some Small Molecules
128.
Thermodynamic Property Of Imidazolium-based ILs, Theoretical And Experimental Study On Structure Of ILs
129.
The Interaction Of Dipolar Solvents And Aromatic Hydrocarbons
130.
Theoretical Studies On The Mechanism Of The Reactions Of Halogen-compounds With Chlone Atom
131.
Theoretical Studies On The Mechanism Of Reactions Radicals With Methyl Iodide And DMS
132.
Theoretical Investigation On The Interaction In M
+
(H
2
O)
1-4
(M=Cu, Ag, Au)
133.
The Photodissociation Mechanisms Of Acrylonitrile: Ab Initio Calculations On Reaction Channels And Surface Intersections
134.
The Ab Initio And Dynamics Study Of Triatomic Reaction System
135.
Theoretical Studies On The Electronic And Thermodynamic Properties Of Ag Nanowires
136.
Study Of Water Dimer (H
2
O)
2
By Ab Initio Method And ABEEM/MM Model
137.
A Theoretical Study On Hydrogen-Bonding Clusters Of Water-Ammonia Molecules
138.
Study Of Phycocyanobilin And Glycine Using Ab Initio And Monte-Carlo Based Molecular Mechanics
139.
Ab Initio Investigations Of The Transport Properties Of Haeckelite Nanotubes And Graphene Junctions
140.
Theoretical Studies On The Reaction Acetone With Halogen And Methyl Radical
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