TY - JOUR
T1 - Quantum reactive scattering using hyperspherical coordinates
T2 - Results for H+H2 and Cl+HCl
AU - Schatz, George C.
N1 - Funding Information:
This research was supported by NSF Grant CHE-8715581. Computations were done at the National Center for Supercomputer Applications at the University of Illinois.
PY - 1988/9/9
Y1 - 1988/9/9
N2 - A coupled-channel hyperspherical coordinate method for doing quantum reactive scattering calculations is presented, along with results of applications to H + H2 (J = 0 and 1) and Cl + HCl (J = 0 on two potential surfaces). The results are in excellent agreement with earlier calculations.
AB - A coupled-channel hyperspherical coordinate method for doing quantum reactive scattering calculations is presented, along with results of applications to H + H2 (J = 0 and 1) and Cl + HCl (J = 0 on two potential surfaces). The results are in excellent agreement with earlier calculations.
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U2 - 10.1016/0009-2614(88)80402-0
DO - 10.1016/0009-2614(88)80402-0
M3 - Article
AN - SCOPUS:0003074090
VL - 150
SP - 92
EP - 98
JO - Chemical Physics Letters
JF - Chemical Physics Letters
SN - 0009-2614
IS - 1-2
ER -