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physics.comp-ph2020
A Science Gateway for Atomic and Molecular Physics
Barry I. Schneider, Klaus~Bartschat, Oleg Zatsarinny +7
We describe the creation of a new Atomic and Molecular Physics science gateway (AMPGateway). The gateway is designed to bring together a subset of the AMP community to work collect…
physics.comp-ph2019★ 2 cited
Towards Run Time Estimation of the Gaussian Chemistry Code for SEAGrid Science Gateway
Angel Beltre, Shehtab Zaman, Kenneth Chiu +3
Accurate estimation of the run time of computational codes has a number of significant advantages for scientific computing. It is required information for optimal resource allocati…