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JCC
2007
151views more  JCC 2007»
15 years 6 months ago
New parallel algorithm for MP2 energy gradient calculations
Abstract: A new parallel algorithm has been developed for calculating the analytic energy derivatives of full accuracy second order Møller-Plesset perturbation theory (MP2). Its m...
Kazuya Ishimura, Peter Pulay, Shigeru Nagase
TOG
2008
116views more  TOG 2008»
15 years 6 months ago
A photometric approach for estimating normals and tangents
This paper presents a technique for acquiring the shape of realworld objects with complex isotropic and anisotropic reflectance. Our method estimates the local normal and tangent ...
Michael Holroyd, Jason Lawrence, Greg Humphreys, T...
CCE
2005
15 years 6 months ago
Computer-aided molecular design using Tabu search
A detailed implementation of the Tabu Search (TS) algorithm for computer-aided molecular design (CAMD) of transition metal catalysts is presented in this paper. Previous CAMD rese...
Bao Lin, Sunitha Chavali, Kyle V. Camarda, David C...
TON
2008
160views more  TON 2008»
15 years 6 months ago
Label space reduction in MPLS networks: how much can a single stacked label do?
Most network operators have considered reducing LSR label spaces (number of labels used) as a way of simplifying management of underlaying Virtual Private Networks (VPNs) and there...
Fernando Solano, Thomas Stidsen, Ramón Fabr...
TPDS
2008
136views more  TPDS 2008»
15 years 6 months ago
Data Gathering with Tunable Compression in Sensor Networks
We study the problem of constructing a data gathering tree over a wireless sensor network in order to minimize the total energy for compressing and transporting information from a ...
Yang Yu, Bhaskar Krishnamachari, Viktor K. Prasann...
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