Results 11 to 20 of about 349,748 (311)

Theoretical Calculation of Self-Propagating High-Temperature Synthesis (SHS) Preparation of AlB12

open access: yes, 2021
Although experimental results of preparing AlB12 by self-propagating high-temperature synthesis using Mg-B2O3-Al2O3 as raw material has been studied, the theoretical calculations for the preparation of AlB12 have not been examined as thoroughly.
Mengge, Dong   +6 more
core   +1 more source

A Simplified Method for Theoretical Sum Frequency Generation Spectroscopy Calculation and Interpretation: the “pop model”

open access: yes, 2023
Sum Frequency Generation (SFG) spectroscopy is a powerful tool to probe molecular environments of oth- erwise nearly inaccessible buried interfaces. Theoretical spectroscopy is required to reveal the structure- spectroscopy relationship. Existing methods
Simone, Pezzotti   +4 more
core   +1 more source

A class–field theoretical calculation [PDF]

open access: yesJournal de théorie des nombres de Bordeaux, 2008
In this paper, we give the complete characterization of the p –torsion subgroups of certain idèle–class groups associated to characteristic p function fields.
openaire   +1 more source

THEORETICAL CALCULATIONS OF AN OSMIUM MOLECULAR SWITCH [PDF]

open access: yesJournal of the Chilean Chemical Society, 2013
ABSTRACT We have investigated the molecular, electronic and optical properties of the [Os(tpy-py) 2 ] 2+ complex (tpy-py = 4’-(4-pyridyl)-2,2’:6’,2’’-terpyridine) and its protonated derivative [Os(tpy-pyH) 2 ] 4+ through Density Functional Relativistic calculations including Scalar and Spin Orbit corrections.
MIRANDA-BARRIENTOS, FERNANDO   +3 more
openaire   +9 more sources

Replication Data for: Spontaneously coherent orbital coupling of counterrotating exciton polaritons in annular perovskite microcavities

open access: yes, 2022
This dataset contains the theoretical calculation for the paper published as Light: Science & Applications 10 (1), 1 ...
Xu, Huawen
core   +1 more source

Theoretical and experimental working life comparison for a helical gear under linear pitting failure [PDF]

open access: yes, 2007
For machine components like gears and bearings, working life calculation is one of the complex issues to deal with. This is because the mechanics of their operation is dependent on many parameters, like loading, friction and lubrication etc.
Khan, Muhammad Ali, Starr, Andrew G.
core   +1 more source

Multilinguals’ language choice for mental calculation [PDF]

open access: yes, 2007
The present study investigates self-reported language choice for mental calculations among 1,454 adult multilinguals from a variety of linguistic, social and ethnic backgrounds.
Dewaele, Jean-Marc
core   +1 more source

Calculation results based on the theoretical model.

open access: yes, 2021
Calculation results based on the theoretical model.
Jinliang Xu (8443134)   +3 more
core   +1 more source

A New 3D 10-Connected Cd(II) Based MOF With Mixed Ligands: A Dual Photoluminescent Sensor for Nitroaroamatics and Ferric Ion

open access: yesFrontiers in Chemistry, 2019
The precise unification of functional groups and photoluminescence properties can give rise to MOFs that can offer diverse applications like selective detection of nitroaromatic compounds (NACs) which are considered to be an important ingredient of ...
Jun Wang   +7 more
doaj   +1 more source

Theoretical calculation-based ammonia affinity: A unified method for evaluating Lewis acidity of organoboronic acid derivatives

open access: yes, 2022
Theoretical calculation-based ammonia affinity (AA) has been found to unifiedly evaluate Lewis acidity of organoboronic acid derivatives [boronates: B(pin), B(neop), B(cat), B(eg), B(nad); boronamides: B(dan), B(aam), B(mdan)], while other methods [LUMO ...
Hiroto, Yoshida   +2 more
core   +1 more source

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