Scribd
Upload
51 views

Energy Conversion Factors

This document provides conversion factors between common units used in energy and thermodynamics. It shows that: 1) 1 Hartree (Eh) is equivalent to 627.509 kilocalories per mole (kcal/mol); 2) 1 Kelvin (K) is equivalent to 0.695035 reciprocal centimeters (cm-1); 3) Energy (E) can be expressed in terms of mass (m), speed of light (c), Planck's constant (h), frequency (ν), Boltzmann's constant (kB), and temperature (T).

Uploaded by

vitoribeiro90
Copyright
© © All Rights Reserved
Available Formats
Download as PDF, TXT or read online on Scribd
51 views

Energy Conversion Factors

This document provides conversion factors between common units used in energy and thermodynamics. It shows that: 1) 1 Hartree (Eh) is equivalent to 627.509 kilocalories per mole (kcal/mol); 2) 1 Kelvin (K) is equivalent to 0.695035 reciprocal centimeters (cm-1); 3) Energy (E) can be expressed in terms of mass (m), speed of light (c), Planck's constant (h), frequency (ν), Boltzmann's constant (kB), and temperature (T).

Uploaded by

vitoribeiro90
Copyright
© © All Rights Reserved
Available Formats
Download as PDF, TXT or read online on Scribd
You are on page 1/ 1

Energy Conversion Factors

m/kg
m/kg
1
E/Eh
4.85087E-35
E/eV
1.78266E-36
-1
Em/kcalmol 7.73035E-38
-1
1.84760E-38
Em/kJmol
-1
2.21022E-40
(1/)/cm
T/K
1.53618E-40
/MHz
7.37250E-45
NA/mol-1
c/ms-1
h/Js
(h/2)/Js
kB/JK-1
me/kg
a0/m
e/C
Eh/J

6.02214E+23
2.99792E+08
6.62607E-34
1.05457E-34
1.38065E-23
9.10938E-31
5.29177E-11
1.60218E-19
4.35974E-18

E/Eh
2.06149E+34
1
3.67493E-02
1.59360E-03
3.80880E-04
4.55634E-06
3.16681E-06
1.51983E-10

E/eV
5.60959E+35
27.2114
1
4.33641E-02
1.03643E-02
1.23984E-04
8.61733E-05
4.13567E-09

Em/kcalmol1
1.29360E+37
627.509
23.0605
1
0.239006
2.85914E-03
1.98720E-03
9.53708E-08

1
T/K
/MHz
Em/kJmol1
(1/)/cm
5.41243E+37 4.52444E+39 6.50966E+39 1.35639E+44
2625.500
2.19475E+05 3.15775E+05 6.57968E+09
96.4853
8065.54
1.16045E+04 2.41799E+08
4.184
349.755
503.220
1.04854E+07
1
83.5935
120.272
2.50607E+06
1.19627E-02
1
1.43878
2.99792E+04
8.31446E-03
0.695035
1
2.08366E+04
3.99031E-07 3.33564E-05 4.79924E-05
1

Example:

1 Eh = 627.509 kcal/mol
1 K = 0.695035 cm-1

Em N A E

Eh

2
0

me a

E c m hc kBT h
2

You might also like