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Keyword [potential energy surfaces]
Result: 1 - 20 | Page: 1 of 3
1.
Theoretical Study Of Potential Energy Surfaces And Ro-vibrational Spectra For Rg
n
-N
2
O
2.
Quantum Chemistry Study On The Reaction Mechanism Of SO
2
And H
2
O In The Formation Of Acid Rain
3.
Theoretical Investigations On The Potential Energy Surfaces Of The Multi-well Chemical Reactions
4.
Quasi-classical Trajectory Calculation Of The Chemical Reaction Ba+HBr, Sr+CF
3
Br And Ca+CF
3
Br
5.
The Microscopic Dynamics Of The Molecules And Molecular Fragments In The Transition Metal Surface Adsorption
6.
The Research Of The Excited-state Intra- And Inter- Molecular Hydrogen Bond Dynamics As Well As Proton Transfer Reaction
7.
Theoretical Studies On The Reaction Mechanisms Of Several Radicals With CF
3
OCHF
2
And CHF
2
OCHF
2
8.
Theoretical Investigations Of Catalytic Mechanism And Regulation Mechanism On Activity For Cysteine Dioxygenase And Its Model Complexes
9.
Accurate Ab Initio Calculations Of Intermolecular Potential Energy Surfaces And The Applications
10.
Study Of Excited-state Potential Energy Surfaces Crossing Dynamics Of Enones
11.
Theoretical Studies Of Potential Energy Surfaces And Quantum Dynamics Of Small Molecules:from Gas Phase To Metal Surfaces
12.
Theoretical Studies On Potential Energy Surfaces And Spectra For Small Semiconductor Molecules
13.
The Theoretical Research Of Excited-state Bridged And Intramolecular Proton Transfer Reaction
14.
Construction Of Potential-energy Surfaces For Large Molecular Systems Based On Neural Networks
15.
Theoretical Studies Of Potential Energy Surfaces And Quantum Dynamics For N+CH,N+C
2
And H
2
/Co Reaction Systems
16.
Full-Dimensional Potential Energy Surfaces And Dynamics Studies Of Polyatomic Molecular Reactions
17.
The Construction Of Potential Energy Surfaces And Theoretical Study Of Dynamics For XH
2
(X?Au
+
,Na) Reaction System
18.
Theoretical Studies Of Potential Energy Surfaces And Dynamics For The HCl+OH And O+C
2
H
2
Reaction Systems
19.
Dynamics Investigations Of Several Polyatomic Reactions On Full Dimensional Potential Energy Surfaces
20.
Theoretical Calculation Of The Excited State Potential Energy Surfaces And Dynamics Of ?-? Enones And Pyrimidine Bases
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