Accurate Sampling with Noisy Forces from Approximate Computing
Abstract
In scientific computing, the acceleration of atomistic computer simulations by means of custom hardware is finding ever growing application. A major limitation, however, is that the high efficiency in terms of performance and low power consumption entails the massive usage of low-precision computing units. Here, based on the approximate computing paradigm, we present an algorithmic method to rigorously compensate for numerical inaccuracies due to low-accuracy arithmetic operations, yet still obtaining exact expectation values using a properly modified Langevin-type equation.
- Publication:
-
arXiv e-prints
- Pub Date:
- July 2019
- DOI:
- 10.48550/arXiv.1907.08497
- arXiv:
- arXiv:1907.08497
- Bibcode:
- 2019arXiv190708497R
- Keywords:
-
- Physics - Computational Physics;
- Condensed Matter - Statistical Mechanics;
- Mathematics - Numerical Analysis;
- Physics - Chemical Physics
- E-Print:
- doi:10.3390/computation8020039