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Heuristic computation of the rovibrational G matrix in optimized molecule-fixed axes. Gmat 2.1.
María Eugenia Castro
Alfonso Niño
Camelia Muñoz-Caro
Published in:
Comput. Phys. Commun. (2010)
Keyphrases
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linear algebra
square root
optimal solution
simulated annealing
search algorithm
dynamic programming
tabu search
heuristic methods
depth first search
combinatorial optimization
greedy heuristic
coefficient matrix