- Definitions|0
- Thesaurus|173
- Abbreviations|1
30 entries under knowledge topic. ×
| molecular mechanics(noun, expression, study, treatment, science) | |
| quantum mechanics(noun, expression, form, study, treatment) | |
| Born-Oppenheimer approximation(noun, expression, study, treatment, science) | |
| Dirac equation(noun, expression, study, treatment, science) | |
| Lewis pair(noun, expression, study, treatment, science) | |
| Schrodinger equation(noun, expression, study, treatment, science) | |
| ab initio calculation(noun, expression, study, treatment, science) | |
| catalysis(noun, study, treatment, science) | |
| chemical database(noun, expression, study, treatment, science) | |
| chemical dynamics(noun, expression, study, treatment, science) | |
| chemical reaction(noun, expression, study, treatment, science) | |
| computational chemistry software package(noun, expression, study, treatment, science) | |
| density functional method(noun, expression, study, treatment, science) | |
| density functional theory(noun, expression, study, treatment, science) | |
| drug design(noun, expression, study, treatment, science) | |
| electronic calculation(noun, expression, study, treatment, science) | |
| first-principle equation(noun, expression, study, treatment, science) | |
| molecular dynamics(noun, expression, study, treatment, science) | |
| molecular wave function(noun, expression, study, treatment, science) | |
| nucleus(noun, study, treatment, science) |
For more, visit
Computational_chemistry on
Power Thesaurus
| APA | Smart Define. (-0001). computational chemistry thesaurus. Retrieved September 24, 2026, from https://smartdefine.org/computational_chemistry/thesaurus/narrower |
| Chicago | Smart Define. -0001. "computational chemistry thesaurus" https://smartdefine.org/computational_chemistry/thesaurus/narrower (accessed September 24, 2026). |
| Harvard | Smart Define -0001, computational chemistry thesaurus, Smart Define, viewed 24 September, 2026, <https://smartdefine.org/computational_chemistry/thesaurus/narrower>. |
| MLA | Smart Define. "computational chemistry thesaurus" 30 November -0001. Web. 24 September 2026. <https://smartdefine.org/computational_chemistry/thesaurus/narrower> |