Sentence examples for Large basis from inspiring English sources

Stone, A. J. Distributed multipole analysis: Stability for large basis sets.

Ab initio calculations of couplings in small molecules with large basis sets and inclusion of electron correlation effects have reached almost quantitative accuracy.

The RVS-CC2 approach is used for accurately predicting optical properties of the p-hydroxybenzylidene-dihydroimidazolinone (p-HBDI) chromophore embedded in green fluorescent protein (GFP) models using quantum mechanical calculations in combination with large basis sets.

They are able to generate very accurate energies with a sufficient large basis set.

However, large basis set remarkably increases the cpu-time of CCSD (T) calculations.

The large basis sets make the CI calculations of Hp-π interactions are even more expensive and CUP-time consuming.

Only the town supervisor, the seventh member on the town board, would continue to be elected on an at-large basis.

Plaintiffs further sought a mandatory injunction requiring defendants to conduct the next primary and general elections for legislators on an at-large basis throughout the State.

In 2000, delegates to the church's national convention put a new bishop in his seat in Washington but allowed him to serve on an at-large basis for four more years.

Plaintiffs requested that, unless the November 1962 election and elections thereafter were conducted on an at-large basis, the court enjoin defendants from performing various election duties until such time as the General Assembly should submit for a referendum vo e by eligible state voters an amendment to Art.

Mr. Fishkin is hoping to use the Internet to conduct "deliberative polling" on a much larger basis.