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The Journal of Chemical Physics
|
March 22, 2024
Convergent ab initio analysis of the multi-channel HOBr + H reaction
Ian T Beck, Mitchell E Lahm, Gary E Douberly, et al.
The Journal of Physical Chemistry. A
|
September 29, 2023
Competition between Solvent···Solvent and Solvent···Solute Interactions in the Microhydration of the Tetrafluoroborate Anion, BF<sub>4</sub><sup>-</sup>(H<sub>2</sub>O)<sub></sub>
Laura N Olive, Eric V Dornshuld, Henry F Schaefer, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Homoleptic Carbonyls of the Second-Row Transition Metals: Evaluation of Hartree-Fock and Density Functional Theory Methods
Xuejun Feng, Jiande Gu, Yaoming Xie, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 1, 2018
Re-examining ammonia addition to the Criegee intermediate: converging to chemical accuracy
Jonathon P Misiewicz, Sarah N Elliott, Kevin B Moore, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
The 2'-deoxyadenosine-5'-phosphate anion, the analogous radical, and the different hydrogen-abstracted radical anions: molecular structures and effects on DNA damage
Ruobing Hou, Jiande Gu, Yaoming Xie, et al.
The Journal of Chemical Physics
|
July 23, 2004
The microwave and infrared spectroscopy of benzaldehyde: conflict between theory and experimental deductions
Lucas D Speakman, Brian N Papas, H Lee Woodcock, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 1, 2019
tert-Butyl peroxy radical: ground and first excited state energetics and fundamental frequencies
Peter R Franke, Kevin B Moore, Henry F Schaefer, et al.
Dalton Transactions (Cambridge, England : 2003)
|
May 7, 2009
From two-electron via four-electron to six-electron donor carbonyl groups in trinuclear derivatives of the oxophilic metal niobium
Bin Peng, Qian-Shu Li, Yaoming Xie, et al.
Inorganic Chemistry
|
June 4, 2009
Binuclear cobalt thiocarbonyl carbonyl derivatives: comparison with homoleptic binuclear cobalt carbonyls
Zhong Zhang, Qian-Shu Li, Yaoming Xie, et al.
Inorganic Chemistry
|
February 25, 2009
Iron carbonyl thiocarbonyls: effect of substituting a thiocarbonyl group for a carbonyl group in mononuclear and binuclear iron carbonyl derivatives
Zhong Zhang, Qian-Shu Li, Yaoming Xie, et al.
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of 57
Search research articles
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Showing results (291-300 of 570) with videos related to
Sort By:
Page
of 57
The Journal of Chemical Physics
|
March 22, 2024
Convergent ab initio analysis of the multi-channel HOBr + H reaction
Ian T Beck, Mitchell E Lahm, Gary E Douberly, et al.
The Journal of Physical Chemistry. A
|
September 29, 2023
Competition between Solvent···Solvent and Solvent···Solute Interactions in the Microhydration of the Tetrafluoroborate Anion, BF<sub>4</sub><sup>-</sup>(H<sub>2</sub>O)<sub></sub>
Laura N Olive, Eric V Dornshuld, Henry F Schaefer, et al.
Journal of Chemical Theory and Computation
|
December 4, 2015
Homoleptic Carbonyls of the Second-Row Transition Metals: Evaluation of Hartree-Fock and Density Functional Theory Methods
Xuejun Feng, Jiande Gu, Yaoming Xie, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 1, 2018
Re-examining ammonia addition to the Criegee intermediate: converging to chemical accuracy
Jonathon P Misiewicz, Sarah N Elliott, Kevin B Moore, et al.
The Journal of Physical Chemistry. B
|
July 21, 2006
The 2'-deoxyadenosine-5'-phosphate anion, the analogous radical, and the different hydrogen-abstracted radical anions: molecular structures and effects on DNA damage
Ruobing Hou, Jiande Gu, Yaoming Xie, et al.
The Journal of Chemical Physics
|
July 23, 2004
The microwave and infrared spectroscopy of benzaldehyde: conflict between theory and experimental deductions
Lucas D Speakman, Brian N Papas, H Lee Woodcock, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 1, 2019
tert-Butyl peroxy radical: ground and first excited state energetics and fundamental frequencies
Peter R Franke, Kevin B Moore, Henry F Schaefer, et al.
Dalton Transactions (Cambridge, England : 2003)
|
May 7, 2009
From two-electron via four-electron to six-electron donor carbonyl groups in trinuclear derivatives of the oxophilic metal niobium
Bin Peng, Qian-Shu Li, Yaoming Xie, et al.
Inorganic Chemistry
|
June 4, 2009
Binuclear cobalt thiocarbonyl carbonyl derivatives: comparison with homoleptic binuclear cobalt carbonyls
Zhong Zhang, Qian-Shu Li, Yaoming Xie, et al.
Inorganic Chemistry
|
February 25, 2009
Iron carbonyl thiocarbonyls: effect of substituting a thiocarbonyl group for a carbonyl group in mononuclear and binuclear iron carbonyl derivatives
Zhong Zhang, Qian-Shu Li, Yaoming Xie, et al.
Page
of 57