Covalent bond fragmentation suitable to describe solids in the fragment molecular orbital method

DG Fedorov, JH Jensen, RC Deka… - The Journal of Physical …, 2008 - ACS Publications
To improve the accuracy of the fragment molecular orbital method (FMO), we introduce a
new fragmentation scheme based on using frozen orbitals to describe fractioned bonds. By …
被引用次数：86 相关文章

[引用][C] Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital Method

DG Fedorov, JH Jensen, RC Deka… - The Journal of Physical …, 2008 - cir.nii.ac.jp
Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital
Method | CiNii Research CiNii 国立情報学研究所 学術情報ナビゲータ[サイニィ] 詳細へ移動 検索 …

[引用][C] Covalent bond fragmentation suitable to describe solids in the fragment molecular orbital method

DG Fedorov, K Kitaura, JH Jensen… - The Journal of Physical …, 2008 - elibrary.ru
Covalent bond fragmentation suitable to describe solids in the fragment molecular orbital
method КОРЗИНА ПОИСК НАВИГАТОР ЖУРНАЛЫ КНИГИ ПАТЕНТЫ ПОИСК АВТОРЫ …

[引用][C] Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital Method

DG Fedorov, JH Jensen, RC Deka… - Journal of Physical …, 2008 - ui.adsabs.harvard.edu
Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital
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[引用][C] Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital Method

DG Fedorov, JH Jensen, RC Deka, K Kitaura - The Journal of Physical …, 2008 - infona.pl
Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital
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Covalent bond fragmentation suitable to describe solids in the fragment molecular orbital method.

DG Fedorov, JH Jensen, RC Deka… - The Journal of Physical …, 2008 - europepmc.org
To improve the accuracy of the fragment molecular orbital method (FMO), we introduce a
new fragmentation scheme based on using frozen orbitals to describe fractioned bonds. By …

Covalent bond fragmentation suitable to describe solids in the fragment molecular orbital method

DG Fedorov, JH Jensen, RC Deka… - The journal of …, 2008 - pubmed.ncbi.nlm.nih.gov
To improve the accuracy of the fragment molecular orbital method (FMO), we introduce a
new fragmentation scheme based on using frozen orbitals to describe fractioned bonds. By …

Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital Method

DG Fedorov, J Jensen, RC Deka… - Journal of Physical …, 2008 - hero.epa.gov
To improve the accuracy of the fragment molecular orbital method (FMO), we introduce a
new fragmentation scheme based on using frozen orbitals to describe fractioned bonds. By …

[引用][C] Covalent Bond Fragmentation Suitable To Describe Solids in the Fragment Molecular Orbital Method

DG FEDOROV, JH JENSEN… - The Journal of …, 2008 - American Chemical Society