# Basis set (chemistry)

## Papers overview

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Highly Cited

2010

Highly Cited

2010

- 2010

We develop the thermodynamic underpinnings of a two-dimensional volatility basis set (2D-VBS) employing saturation mass… (More)

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Highly Cited

2010

Highly Cited

2010

- Journal of Machine Learning Research
- 2010

Sparse coding—that is, modelling data vectors as sparse linear combinations of basis elements—is widely used in machine learning… (More)

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Highly Cited

2009

Highly Cited

2009

- ICML
- 2009

Sparse coding---that is, modelling data vectors as sparse linear combinations of basis elements---is widely used in machine… (More)

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Highly Cited

2007

Highly Cited

2007

- Journal of Chemical Information and Modeling
- 2007

Basis sets are some of the most important input data for computational models in the chemistry, materials, biology, and other… (More)

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Highly Cited

2007

Highly Cited

2007

- The Journal of chemical physics
- 2007

We present a library of Gaussian basis sets that has been specifically optimized to perform accurate molecular calculations based… (More)

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Highly Cited

2003

Highly Cited

2003

- 2003

A series of correlation consistent basis sets have been developed for the postd gr up 16–18 elements in conjunction with small… (More)

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Highly Cited

2002

Highly Cited

2002

Reconstruction of Abel-transformable images : The Gaussian basis-set expansion Abel transform method

- 2002

In this article we present a new method for reconstructing three-dimensional ~3D! images with cylindrical symmetry from their two… (More)

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Highly Cited

1996

Highly Cited

1996

- 1996

We describe a simple method to automate the geometric optimization of molecular orbital calculations of supermolecules on… (More)

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Highly Cited

1992

Highly Cited

1992

- 1992

The calculation of accurate electron affinities (EAs) of atomic or molecular species is one of the most challenging tasks in… (More)

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Highly Cited

1991

Highly Cited

1991

- CVPR
- 1991

We present an approach t o the detection and identification of human faces and describe a working, near-real-time face… (More)

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