57 search results - page 2 / 12 » Performance of parallel TURBOMOLE for density functional cal... |
SIAMSC
2011
14 years 10 days ago
2011
Abstract. An efficient parallel algorithm is presented and tested for computing selected components of H−1 where H has the structure of a Hamiltonian matrix of two-dimensional la...
78
Voted
CDES
2006
14 years 11 months ago
2006
: Over the last three decades there has been significant progress in the first principles methods for calculating the properties of materials at the quantum level. They have largel...
IPPS
2006
IEEE
15 years 3 months ago
2006
IEEE
Wireless Sensor Networks (WSNs) are characterized by having scarce resources. The usual way of designing network functions is to consider them isolatedly, a strategy which may not...
71
Voted
JCC
2008
14 years 9 months ago
2008
: We propose the algorithm to evaluate the Coulomb potential in the ab initio density functional calculation on the graphics processor unit (GPU). The numerical accuracy required f...
86
Voted
DATE
2008
IEEE
15 years 4 months ago
2008
IEEE
Abstract— We present a general method to evaluate RF BuiltIn Self-Test (BIST) techniques during the design stage. In particular, the adaptive kernel estimator is used to construc...