60 entries under science topic. ×

2
molecular mechanics(noun, expression, study, treatment)
2
quantum mechanics(noun, expression, form, study, treatment)
2
vibrational frequency(noun, expression, form, study)
2
Born-Oppenheimer approximation(noun, expression, study, treatment)
2
Dirac equation(noun, expression, study, treatment)
2
Lewis pair(noun, expression, study, treatment)
2
Schrodinger equation(noun, expression, study, treatment)
2
ab initio calculation(noun, expression, study, treatment)
2
ab initio method(noun, expression, form, study)
2
ab initio quantum chemistry method(noun, expression, form, study)
2
absolute energy(noun, expression, form, study)
2
catalysis(noun, study, treatment, knowledge)
2
chemical database(noun, expression, study, treatment)
2
chemical dynamics(noun, expression, study, treatment)
2
chemical phenomenon(noun, expression, form, study)
2
chemical problem(noun, expression, form, study)
2
chemical reaction(noun, expression, study, treatment)
2
computational chemistry method(noun, expression, form, study)
2
computational chemistry software package(noun, expression, study, treatment)
2
computer program(noun, expression, form, study)
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APASmart Define. (-0001). computational chemistry thesaurus. Retrieved September 27, 2026, from https://smartdefine.org/computational_chemistry/thesaurus/narrower
ChicagoSmart Define. -0001. "computational chemistry thesaurus" https://smartdefine.org/computational_chemistry/thesaurus/narrower (accessed September 27, 2026).
HarvardSmart Define -0001, computational chemistry thesaurus, Smart Define, viewed 27 September, 2026, <https://smartdefine.org/computational_chemistry/thesaurus/narrower>.
MLASmart Define. "computational chemistry thesaurus" 30 November -0001. Web. 27 September 2026. <https://smartdefine.org/computational_chemistry/thesaurus/narrower>