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Fragmentation: Toward Accurate Calculations on Complex Molecular Systems
Language: en
Pages: 376
Authors: Mark S. Gordon
Categories: Science
Type: BOOK - Published: 2017-10-23 - Publisher: John Wiley & Sons

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Fragmentation: Toward Accurate Calculations on Complex Molecular Systems introduces the reader to the broad array of fragmentation and embedding methods that ar
Fragmentation: Toward Accurate Calculations on Complex Molecular Systems
Language: en
Pages: 499
Authors: Mark S. Gordon
Categories: Science
Type: BOOK - Published: 2017-08-04 - Publisher: John Wiley & Sons

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Fragmentation: Toward Accurate Calculations on Complex Molecular Systems introduces the reader to the broad array of fragmentation and embedding methods that ar
Recent Advances of the Fragment Molecular Orbital Method
Language: en
Pages: 606
Authors: Yuji Mochizuki
Categories: Science
Type: BOOK - Published: 2021-01-04 - Publisher: Springer Nature

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This book covers recent advances of the fragment molecular orbital (FMO) method, consisting of 5 parts and a total of 30 chapters written by FMO experts. The FM
London Dispersion Forces in Molecules, Solids and Nano-structures
Language: en
Pages: 390
Authors: János Ángyán
Categories: Science
Type: BOOK - Published: 2020-04-03 - Publisher: Royal Society of Chemistry

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London dispersion interactions are responsible for numerous phenomena in physics, chemistry and biology. Recent years have seen the development of new, physical
The Fragment Molecular Orbital Method
Language: en
Pages: 304
Authors: Dmitri Fedorov
Categories: Science
Type: BOOK - Published: 2009-05-14 - Publisher: CRC Press

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Answering the need to facilitate quantum-chemical calculations of systems with thousands of atoms, Kazuo Kitaura and his coworkers developed the Fragment Molecu