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The Journal of Physical Chemistry. A
|
June 9, 2020
Different Carbonate Isomers Formed by the Addition of CO<sub>2</sub> to M<sub>3</sub>O<sub>6</sub><sup>-</sup> for M = Ti, Zr, and Hf
Yiqin Hu, Rudradatt R Persaud, Monica Vasiliu, et al.
Inorganic Chemistry
|
June 29, 2013
Thorium fluorides ThF, ThF2, ThF3, ThF4, ThF3(F2), and ThF5- characterized by infrared spectra in solid argon and electronic structure and vibrational frequency calculations
Lester Andrews, K Sahan Thanthiriwatte, Xuefeng Wang, et al.
The Journal of Physical Chemistry. A
|
July 26, 2013
Prediction of structures and atomization energies of small silver clusters, (Ag)n, n < 100
Mingyang Chen, Jason E Dyer, Keijing Li, et al.
Dalton Transactions (Cambridge, England : 2003)
|
May 21, 2016
The niobium oxoazides [NbO(N3)3], [NbO(N3)3·2CH3CN], [(bipy)NbO(N3)3], Cs2[NbO(N3)5] and [PPh4]2[NbO(N3)5]
Ralf Haiges, Monica Vasiliu, David A Dixon, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 19, 2016
The Uranium(VI) Oxoazides [UO<sub>2</sub> (N<sub>3</sub> )<sub>2</sub> ⋅CH<sub>3</sub> CN], [(bipy)<sub>2</sub> (UO<sub>2</sub> )<sub>2</sub> (N<sub>3</sub> )<sub>4</sub> ], [(bipy)UO<sub>2</sub> (N<sub>3</sub> )<sub>3</sub> ]<sup>-</sup> , [UO<sub>2</sub> (N<sub>3</sub> )<sub>4</sub> ]<sup>2-</sup> , and [(UO<sub>2</sub> )<sub>2</sub> (N<sub>3</sub> )<sub>8</sub> ]<sup>4</sup>
Ralf Haiges, Monica Vasiliu, David A Dixon, et al.
Journal of Molecular Graphics & Modelling
|
February 11, 2012
Construction of a robust, large-scale, collaborative database for raw data in computational chemistry: the Collaborative Chemistry Database Tool (CCDBT)
Mingyang Chen, Amanda C Stott, Shenggang Li, et al.
Inorganic Chemistry
|
March 14, 2012
Thorium(IV)-selenate clusters containing an octanuclear Th(IV) hydroxide/oxide core
Karah E Knope, Monica Vasiliu, David A Dixon, et al.
Journal of Chemical Theory and Computation
|
July 12, 2016
Use of Improved Orbitals for CCSD(T) Calculations for Predicting Heats of Formation of Group IV and Group VI Metal Oxide Monomers and Dimers and UCl6
Zongtang Fang, Zachary Lee, Kirk A Peterson, et al.
The Journal of Physical Chemistry. A
|
August 10, 2010
Structures and heats of formation of simple alkaline earth metal compounds: fluorides, chlorides, oxides, and hydroxides for Be, Mg, and Ca
Monica Vasiliu, David Feller, James L Gole, et al.
The Journal of Physical Chemistry. A
|
May 24, 2012
Spectroscopic and energetic properties of thorium(IV) molecular clusters with a hexanuclear core
Monica Vasiliu, Karah E Knope, L Soderholm, et al.
Page
of 35
Search research articles
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Showing results (81-90 of 341) with videos related to
Sort By:
Page
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The Journal of Physical Chemistry. A
|
June 9, 2020
Different Carbonate Isomers Formed by the Addition of CO<sub>2</sub> to M<sub>3</sub>O<sub>6</sub><sup>-</sup> for M = Ti, Zr, and Hf
Yiqin Hu, Rudradatt R Persaud, Monica Vasiliu, et al.
Inorganic Chemistry
|
June 29, 2013
Thorium fluorides ThF, ThF2, ThF3, ThF4, ThF3(F2), and ThF5- characterized by infrared spectra in solid argon and electronic structure and vibrational frequency calculations
Lester Andrews, K Sahan Thanthiriwatte, Xuefeng Wang, et al.
The Journal of Physical Chemistry. A
|
July 26, 2013
Prediction of structures and atomization energies of small silver clusters, (Ag)n, n < 100
Mingyang Chen, Jason E Dyer, Keijing Li, et al.
Dalton Transactions (Cambridge, England : 2003)
|
May 21, 2016
The niobium oxoazides [NbO(N3)3], [NbO(N3)3·2CH3CN], [(bipy)NbO(N3)3], Cs2[NbO(N3)5] and [PPh4]2[NbO(N3)5]
Ralf Haiges, Monica Vasiliu, David A Dixon, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 19, 2016
The Uranium(VI) Oxoazides [UO<sub>2</sub> (N<sub>3</sub> )<sub>2</sub> ⋅CH<sub>3</sub> CN], [(bipy)<sub>2</sub> (UO<sub>2</sub> )<sub>2</sub> (N<sub>3</sub> )<sub>4</sub> ], [(bipy)UO<sub>2</sub> (N<sub>3</sub> )<sub>3</sub> ]<sup>-</sup> , [UO<sub>2</sub> (N<sub>3</sub> )<sub>4</sub> ]<sup>2-</sup> , and [(UO<sub>2</sub> )<sub>2</sub> (N<sub>3</sub> )<sub>8</sub> ]<sup>4</sup>
Ralf Haiges, Monica Vasiliu, David A Dixon, et al.
Journal of Molecular Graphics & Modelling
|
February 11, 2012
Construction of a robust, large-scale, collaborative database for raw data in computational chemistry: the Collaborative Chemistry Database Tool (CCDBT)
Mingyang Chen, Amanda C Stott, Shenggang Li, et al.
Inorganic Chemistry
|
March 14, 2012
Thorium(IV)-selenate clusters containing an octanuclear Th(IV) hydroxide/oxide core
Karah E Knope, Monica Vasiliu, David A Dixon, et al.
Journal of Chemical Theory and Computation
|
July 12, 2016
Use of Improved Orbitals for CCSD(T) Calculations for Predicting Heats of Formation of Group IV and Group VI Metal Oxide Monomers and Dimers and UCl6
Zongtang Fang, Zachary Lee, Kirk A Peterson, et al.
The Journal of Physical Chemistry. A
|
August 10, 2010
Structures and heats of formation of simple alkaline earth metal compounds: fluorides, chlorides, oxides, and hydroxides for Be, Mg, and Ca
Monica Vasiliu, David Feller, James L Gole, et al.
The Journal of Physical Chemistry. A
|
May 24, 2012
Spectroscopic and energetic properties of thorium(IV) molecular clusters with a hexanuclear core
Monica Vasiliu, Karah E Knope, L Soderholm, et al.
Page
of 35