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  3. Computational Chemistry Course

Computational Chemistry Course

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Basic course of 4 hours free

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Completion certificate

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Practical activities

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Online and lifelong course

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Free basic course

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Workload:18 hours

What will I learn?

Fur awoodda kimistariga xisaabinta adigoo isticmaalaya koorskeena dhamaystiran ee loogu talagalay xirfadlayaasha kimistariga. Gal qoto dheer kimistariga kuantumka, baro isla'egta Schrödinger, oo sahami aragtida orbital-ka molecular-ka. Hel xirfad ku saabsan software-ka hormuudka ah sida Gaussian iyo ORCA, oo kobci xirfadahaaga ku saabsan falanqaynta xogta iyo qoraalka warbixinta. Baro sida loo saadaaliyo guryaha molecular-ka, loo falanqeeyo falcelinta elektarooniga ah, oo loo sameeyo xisaabinta tamarta. Sare u qaad khibradaada adigoo isticmaalaya waxyaabo tayo sare leh oo loogu talagalay codsiyada dhabta ah.

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Learning outcomes

Enhance the development of the practical skills listed below

Baro moodellada kuantumka: Faham qaab-dhismeedyada atomiga adigoo isticmaalaya makaanikada kuantumka.

Falanqee xogta xisaabinta: Ka soo saar aragtiyo simulaashinnada kimistariga ee murugsan.

Isticmaal software-ka kimistariga: Ku shaqee Gaussian iyo ORCA xisaabinta saxda ah.

Gudbi natiijooyinka: Soo bandhig natiijooyinka sayniska si cad oo saameyn leh.

Saadaali guryaha molecular-ka: Isticmaal aragtida orbital-ka molecular-ka saadaalinta saxda ah.