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Optimum scaling in a Monte Carlo method for quantum chemistry

✍ Scribed by Eduardo A. Castro


Publisher
John Wiley and Sons
Year
1978
Tongue
English
Weight
81 KB
Volume
13
Category
Article
ISSN
0020-7608

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Antisymmetry in the quantum Monte Carlo
✍ R. Bianchi; D. Bressanini; P. Cremaschi; G. Morosi πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 288 KB

The problem of antisymmetry in the quantum Monte Carlo method is handled by a technique able to build up mobile nodal surfaces, self-adapting to the signed psip distribution. We define a function A as a sum of Gaussians, each one centered on a psip and with its own sign. This sum is extended to the