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TURBOMOLE

Known as: TURBOMOL 
TURBOMOLE is an ab initio computational chemistry program that implements various quantum chemistry methods. It was initially developed by the group… Expand
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2017
2017
The fundamental objective of this research project was to develop a computational model, using high-level quantum chemical… Expand
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2016
2016
Hartree--Fock theory is one of the most ancient methods of computational chemistry, but up to the present day quantum chemical… Expand
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2015
2015
The molecular geometries of boraphosphabenzene (BP-benzene) and boron phosphorus coronene (BP-coronene) can be misinterpreted… Expand
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2015
2015
We present the GW100 set. GW100 is a benchmark set of the ionization potentials and electron affinities of 100 molecules computed… Expand
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2011
2011
The programs ESCF, EGRAD, and AOFORCE are parts of the TURBOMOLE program package and compute excited-state properties and ground… Expand
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2008
2008
The conduction properties of <x,ro-diaminoalkanes and hydrazine bridging gold electrodes are investigated llsing density functio… Expand
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2008
2008
Abstract : The anthrax attacks of September 18, 2001 refocused attention on methods of asymmetric warfare including introduction… Expand
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2005
2005
For more than two decades the physical and chemical properties of metal clusters have been investigated. However, the strong… Expand
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1998
1984
1984
MEBIS is a t ranspor tab le scanning e lect ron microscope which works " i n s i t u " . I t can be placed on the objet to be s… Expand
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