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Reactive Dynamics for Zn( 3 P) + H2/D 2/HD → ZnH/ZnD + H/D: Rotational Populations in ZnH/ZnD Products Michael R. Salazar and Jack Simons Henry Eyring Center for Theoretical Chemistry Chemistry Department
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Document Date: 2008-07-30 11:25:20


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pence / /

Facility

Theoretical Chemistry Chemistry Department University of Utah Salt Lake City / /

IndustryTerm

tessellated energy surfaces / metal / reaction energy profile / rotational and vibrational energy disposal / potential energy surfaces / initio multiconfigurational potential energy / local energy tessellation / reactive energy surface / initio potential energy surface7 / gas-phase reactions / energy release / energy surface curvature / exit-channel potential energy surface / metal hydride product / energy gradients / energy / /

Organization

Jack Simons Henry Eyring Center / Theoretical Chemistry Chemistry Department University of Utah Salt Lake City / U.S. Securities and Exchange Commission / /

Person

Salazar / Jack Simons Henry / /

Position

Jahn-Teller / initial conditions representative / representative / second order Jahn-Teller / /

ProvinceOrState

Utah / ZnH / /

Technology

simulation / /

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