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ACES (computational chemistry)
Known as:
Ace (disambiguation)
, CFOUR
Aces II (Advanced Concepts in Electronic Structure Theory) is an ab initio computational chemistry package for performing high-level quantum chemical…
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Related topics
Related topics
4 relations
Ab initio quantum chemistry methods
Computational chemistry
Coupled cluster
List of quantum chemistry and solid-state physics software
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
2019
2019
Understanding Fault Scenarios and Impacts through Fault Injection Experiments in Cielo
Valerio Formicola
,
Saurabh Jha
,
+13 authors
B. Kramer
arXiv.org
2019
Corpus ID: 19056337
We present a set of fault injection experiments performed on the ACES (LANL/SNL) Cray XE supercomputer Cielo. We use this…
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2015
2015
Millimeter Wave Spectroscopy and Equilibrium Structure Determination of Pyrimidine (m-C_4H_4N_2)
Zachary N. Heim
,
Brent K Amberger
,
Brian J. Esselman
,
R. Woods
,
R. McMahon
2015
Corpus ID: 101979121
Pyrimidine, the meta substituted dinitrogen analog of benzene, has been studied in the mm-wave region from 260 – 360 GHz…
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Review
2012
Review
2012
Evaluation of a Simulation-Based Registered Nurse Residency Program
P. Young
2012
Corpus ID: 74642387
A community hospital and a university recendy collaborated to implement a pilot residency program utilizing patient simulation…
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2012
2012
Satisfação de utentes do ACES Tâmega I – Baixo Tâmega
C. Machado
2012
Corpus ID: 73162864
2010
2010
Evaluating Surface Optimization Techniques Using a Fast-time Airport Surface Simulation
K. Griffin
,
Peter Yu
,
David Barkin Rappaport
,
J. Clarke
2010
Corpus ID: 62068062
The application of NASA’s Airspace Concept Evaluation System (ACES) Terminal Model Enhancement (TME), a fast-time airport surface…
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2010
2010
Avaliação da satisfação dos profissionais do ACES Baixo Vouga II
José Manuel Ramos Cerdeira
2010
Corpus ID: 187882727
2009
2009
JVIEW Visualization for Virtual Airspace Modeling and Simulation
Aaron McVay
,
D. Krisher
,
Patrick Fisher
2009
Corpus ID: 107436638
Abstract : This Final Technical Report discusses the accomplishments of an effort to support NASA and FAA goals for visualization…
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2009
2009
ACES-II ejection seat based on modular design
Wang Ban
2009
Corpus ID: 111454567
Modular design aims to reduce the maintenance man-hour and logistics expense of ACES-Ⅱ(Advanced Concept Ejection System) ejection…
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2008
2008
ACES TM Signal Sequence and YebF Expression Systems
2008
Corpus ID: 46993562
E. coli is the host strain of choice for the production of recombinant proteins. Despite its long and successful history, several…
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2001
2001
Four-Reference State-Specific Brillouin-Wigner Coupled-Cluster Method: Study of the IBr Molecule
J. Pittner
,
Ondřej Demel
,
P. Čársky
,
I. Hubač
2001
Corpus ID: 11955448
We implemented the state-specific Brillouin–Wigner coupled-cluster method for the complete model space spanned by four reference…
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