Category
page 1Theoretical chemists

Jacobus Henricus van 't Hoff
Dutch physical and organic chemist (1852-1911)
Ilya Prigogine
Russian-Belgian physical chemist (1917–2003)
Kenichi Fukui
Japanese chemist (1918–1998)

John Pople
Nobel prize winning British chemist (1925-2004)

Rudolph A. Marcus
Canadian chemist
Roald Hoffmann
Nobel laureate organic and inorganic chemist and Holocaust child survivor (born 1937)
Martin Karplus
Austrian-born American theoretical chemist (1930–2024)
Arieh Warshel
chemist, biochemist and biophysicist

Abdul Qadeer Khan
Pakistani nuclear engineer (1936–2021)
Erich Hückel
German physical chemist known for the Debye-Hückel Theory and the Hückel method
Hertha Sponer
German physicist and chemist (1895–1968)
Henry Eyring
Mexican-born American theoretical chemist (1901-1981)
John Lennard-Jones
British scientist (1894-1954)
Charlotte Froese Fischer
Canadian-American applied mathematician and computer scientist
Oktay Sinanoğlu
Turkish chemist (1935–2015)
Charles Coulson
British applied mathematician, theoretical chemist and religious author (1910–1974)
Nevil Sidgwick
English theoretical chemist (1873–1952)

Joshua Jortner
Israeli chemist (born 1933)

Per-Olov Löwdin
Swedish physicist (1916-2000)
Reinhart Ahlrichs
German theoretical chemist (1940-2016)
Clemens Roothaan
Dutch-American physicist (1918-2019)
H. Christopher Longuet-Higgins
British chemist and cognitive scientist (1923-2004)
Leticia González
Spanish theoretical chemist
Ariel Fernández
Argentine biophysicist
Raymond Daudel
French chemist (1920–2006)
David Buckingham
Australian chemist and cricketer (1930–2021)
George G. Hall
British mathematician
Camille Sandorfy
Canadian chemist (1920–2006)
Spiridoula Matsika
Greek theoretical chemist
Vincenzo Barone
Italian chemist (born 1952)
Alberte Pullman
French chemist (1920–2011)
Peter Schwerdtfeger
German chemist (b. 1955)
Axel D. Becke
German chemist
Hans Primas
Swiss chemist and university professor (1928-2014)
Graham Richards
English theoretical chemist
Abraham Nitzan
Israeli chemist

Walter Thiel
German chemist (1949–2019)
Lionel Salem
French chemist (b. 1937)

Tang Aoqing
Chinese chemist (1915-2008)
Keiji Morokuma
Japanese theoretical chemist

Nicholas C. Handy
British chemist
Odile Eisenstein
French chemist
Isaac Bersuker
American physicist and chemist
Anna Krylov
theoretical chemist