Add to ORKGThe detailed dynamics of the CH4 + Cl --> HCl + CH3 reaction has been investigated by means of the quasiclassical trajectory approach. The properties analyzed can be interpreted in terms of the main topological features of the potential energy surface used. On the basis of the theoretical results, two reaction channels are proposed: one is a direct channel and the other is a complex one
The dynamics of the Cl + HD reaction has been studied by means of quasi-classical trajectory calcula...
We report a theoretical investigation of the CH4 + Cl hydrogen abstraction reaction in the framework...
Ellerbrock R, Mantheuwe U. Natural reaction channels in H+ CHD3 H-2 + CD3. FARADAY DISCUSSIONS. 2018...
The reaction of CH4+O(P-3)-> CH3+OH was studied with the quasiclassical trajectory calculation. Both...
The dynamics of the NH + H --> N + H-2 reaction has been investigated by means of the 3D quasiclassi...
We report a new global, full-dimensional ground-state potential energy surface (PES) of the O(D-1) +...
In the quantum chemical approach, chemical reaction mechanisms are investigated based on a potential...
We study the reaction Cl + CH(4)--> HCl + CH(3) using a 2-D potential energy surface obtained by fit...
It is still a formidable challenge to study CH2O + CH3. -> CHO + CH4 reaction in the gas phase by tr...
The dynamics of the reaction O(D-1) + HCl -> ClO + H, OH + Cl has been investigated in detail by mea...
An eight-dimensional quantum dynamical model is proposed and applied to the title reaction. The reac...
The subject of chemical dynamics typically consists of two steps. The first is the study of the beha...
Quasiclassical state-to-state dynamics of the F+HCl reaction on a ground 1A potential energy surfac
We studied the effects of collision energy (ET) on the dynamics of the title reaction using the quas...
The paper presents a theoretical study of the dynamics of the H + HCl system on the potential energy...
The dynamics of the Cl + HD reaction has been studied by means of quasi-classical trajectory calcula...
We report a theoretical investigation of the CH4 + Cl hydrogen abstraction reaction in the framework...
Ellerbrock R, Mantheuwe U. Natural reaction channels in H+ CHD3 H-2 + CD3. FARADAY DISCUSSIONS. 2018...
The reaction of CH4+O(P-3)-> CH3+OH was studied with the quasiclassical trajectory calculation. Both...
The dynamics of the NH + H --> N + H-2 reaction has been investigated by means of the 3D quasiclassi...
We report a new global, full-dimensional ground-state potential energy surface (PES) of the O(D-1) +...
In the quantum chemical approach, chemical reaction mechanisms are investigated based on a potential...
We study the reaction Cl + CH(4)--> HCl + CH(3) using a 2-D potential energy surface obtained by fit...
It is still a formidable challenge to study CH2O + CH3. -> CHO + CH4 reaction in the gas phase by tr...
The dynamics of the reaction O(D-1) + HCl -> ClO + H, OH + Cl has been investigated in detail by mea...
An eight-dimensional quantum dynamical model is proposed and applied to the title reaction. The reac...
The subject of chemical dynamics typically consists of two steps. The first is the study of the beha...
Quasiclassical state-to-state dynamics of the F+HCl reaction on a ground 1A potential energy surfac
We studied the effects of collision energy (ET) on the dynamics of the title reaction using the quas...
The paper presents a theoretical study of the dynamics of the H + HCl system on the potential energy...
The dynamics of the Cl + HD reaction has been studied by means of quasi-classical trajectory calcula...
We report a theoretical investigation of the CH4 + Cl hydrogen abstraction reaction in the framework...
Ellerbrock R, Mantheuwe U. Natural reaction channels in H+ CHD3 H-2 + CD3. FARADAY DISCUSSIONS. 2018...