PARAMETERIZATION OF REAXFF POTENTIAL OF MG/AL/SI/O INTERACTION AND INVESTIGATION OF MECHANICAL PROPERTIES FOR S-GLASS

New ReaxFF parameters are developed for the description of Mg/Al/Si/O interaction for the Magnesium Aluminosilicate (MAS) glass structure. The training set contains energy curves from equation of state for various Mg/Al/Si/O crystals, valence angle and bond distance scan, and heat of formation for the Mg/Al/Si/O interactions. A semi-automated Genetic Algorithm assisted by Artificial Neural Network is applied for this parametrization. Validation efforts showed the current ReaxFF parameter set can describe the atomistic structure and property of tectosilicate MAS glass including S-glass. Estimated quasi-static modulus of S-glass structure matches well with experimental value. Analysis shows the key of high modulus of S-glass is numerous Mg-BO (Bridge Oxygen) interactions across the Mg-O-AlSi structure. In addition, atomistic origin of high ductility and progressive failure of S-glass is derived from the reconstruction of the atomic structure, forming Mg-BO-Si interactions that delays fracture formation.

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The Valence Angle at the Bridge Oxygen Atom in Cellulose

Macromolecules ◽

10.1021/ma60067a031 ◽

1979 ◽

Vol 12 (1) ◽

pp. 152-153 ◽

Cited By ~ 4

Author(s):

P. R. Sundararajan

Keyword(s):

Oxygen Atom ◽

Valence Angle ◽

Bridge Oxygen Atom ◽

Bridge Oxygen

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The Molecular Structure of Selenium Dichloride, SeCl2, Determined by Gas Electron Diffraction

Zeitschrift für Naturforschung B ◽

10.1515/znb-1983-0907 ◽

1983 ◽

Vol 38 (9) ◽

pp. 1072-1073 ◽

Cited By ~ 21

Author(s):

Liv Fernholt ◽

Arne Haaland ◽

Ragnhild Seip ◽

Rüdiger Kniep ◽

Lutz Korte

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Diffraction Pattern ◽

Electron Diffraction Pattern ◽

Valence Angle ◽

Bond Distance ◽

Gas Electron Diffraction ◽

Gas Jet ◽

Selenium Dichloride ◽

Nozzle Temperature

AbstractThe electron diffraction pattern of the vapor from a sample of SeCl4 has been recorded with a reservoir and nozzle temperature of about 175 °C. The gas jet was found to consist of SeCl2 (80%) and Cl2 (20%). The bond distance in SeCl2 is ra(Se-Cl) = 2.157(3) Å, the valence angle <ClSeCl = 99.6(5)°.

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The Use of Word Associations for Value Analysis

PsycEXTRA Dataset ◽

10.1037/e473742008-323 ◽

1968 ◽

Author(s):

Lorand B. Szalay ◽

Jack E. Brent ◽

Dale A. Lysne

Keyword(s):

Word Associations ◽

Value Analysis

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Maximum production — minimum cost via value analysis

Production Engineer ◽

10.1049/tpe.1963.0021 ◽

1963 ◽

Vol 42 (3) ◽

pp. 147

Author(s):

N. Taylor

Keyword(s):

Minimum Cost ◽

Value Analysis ◽

Maximum Production

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PROP1 mutations cause progressive failure of anterior pituitary function including adrenal insufficiency

Experimental and Clinical Endocrinology & Diabetes ◽

10.1055/s-2004-819105 ◽

2004 ◽

Vol 112 (S 1) ◽

Author(s):

A Böttner ◽

E Keller ◽

J Kratzsch ◽

J Weigel ◽

A Keller ◽

...

Keyword(s):

Adrenal Insufficiency ◽

Anterior Pituitary ◽

Progressive Failure ◽

Pituitary Function ◽

Anterior Pituitary Function

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Pengujian pada Aplikasi Penggajian Pegawai dengan menggunakan Metode Blackbox

Jurnal Informatika Universitas Pamulang ◽

10.32493/informatika.v5i1.4340 ◽

2020 ◽

Vol 5 (1) ◽

pp. 61

Author(s):

Vadlan Febrian ◽

Muhamad Rizki Ramadhan ◽

Muhammad Faisal ◽

Aries Saifudin

Keyword(s):

Data Entry ◽

Black Box ◽

Application Form ◽

Value Analysis ◽

Test Function ◽

Testing Method ◽

Black Box Testing ◽

Sample Testing ◽

Testing Techniques ◽

Program Error

In this employee payroll application, if there is an error program there will be a loss for employees and the company. Losses for employees, if this application program error occurs then the salary reduction will experience delays due to the difficulty in the process of calculating employee salaries and employees will be late in receiving salaries. Losses for the company, if there is an error program in this application, the company will suffer losses if the employee wants a salary reduction quickly but the company cannot calculate quickly and accurately. In solving this problem, the authors use the black box testing method. Black box testing method is a test that sees the results of execution through test data and ensures the function of the software. Black box testing method has several testing techniques, namely Sample Testing, Boundary Value Analysis, Equivalence Partitions and others. From the testing techniques that have been mentioned, we use the Equivalence Partitions testing technique. Equivalence Partitions are tests that refer to data entry on the employee payroll application form, input will be tested and then put together based on the test function, both valid and invalid values. The expected results of this test are a payroll system for employees who are computerized, have standard rules in the process of developing the program so that it is easy to develop and maintain, and can minimize errors in processing salary calculations for employees.

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