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MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Surprises inExperimental Mathematics
Michael I. ShamosSchool of Computer ScienceCarnegie Mellon University
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Mathematical Discovery
• Where do theorems come from?
• Theorem easy to conjecture, proof is hard– Fermat’s last theorem, four-color theorem
• Theorem surprising, but results from a logical investigation– Fundamental theorem of algebra
• Theorem difficult to invent, straightforward to prove– Hadamard three-circles theorem
– Where do these come from?
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Hadamard Three-Circles Theorem• If f(z) is holomorphic (complex differentiable) on the annulus
centered at the origin and
• then
)(loglog)(loglog)(loglog bMa
raM
r
brM
a
b
bza )(sup)( zfrMrz
a
b
r
• •
•)(aM
)(rM)(bM
How was this theorem ever conjectured?
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Outline• The problem
– Closed-form expression for• The approach
– Build a catalog of real-valued expressions indexed by first 20 digits– Equivalent expressions will “collide”– Look up 1.20205690315959428539
• The discoveries– The Partial Sum Theorem– Overcounting functions– How many ways can n be expressed as an integer power k
j ?
– Expression for – . . .
...2020569031.11
)3(1
3
k k
122
1
kk
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Problem
• Closed form expressions for values of the zeta function
• Euler found an expression for all even values of s:
• No expression is known for even a single odd value, e.g.
1
1)(
ksk
s
ssss
s
Bs 22
121
)!2(
2)1()2(
)3(
2
1;
1
1
11
1
0
BBk
n
nB
n
kkn
)2( s s2is a rational multiple of
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Catalog• Some values of :
2906251531329465
176411)20(;
90)4(;
6)2(
2042
2906251531329465
176411)20(4162033872790000009539.1
20
90)4(516037111381911.08232323
4
6)2(472468482264361.64493406
2
?)3(399731595942851.20205690
12
1152717616113171.20202249
Catalan
0
2)12(
)1(0541772190150.91596559
k
k
kCatalan
)(n
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Other Catalogs
• Sloane’s Encyclopedia of Integer Sequences
– Terrific, but for integer sequences, not reals
• Plouffe’s Inverter
– Huge (215 million entries), but not “natural” expressions from actual mathematical work
• Simon Fraser Inverse Symbolic Calculator
– 50 million constants
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Discovery A
primep
pk
k
k
2
12
2
)(
1
where is the number of primes k)(k
• Is this a coincidence?
• Why the factor of 2?
• Is there a general principle at work?
primepp
kk aa
a
a
k 1
1
)(
1
– In fact,
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Observation
is a partial sum function, i.e.,)(k
kp
primep
k 1)(
otherwise
primejjIwherejIk prime
k
jprime ,0
,1)(,)()(
1
11
)()()()()(k
primeprimepk
kgkIkgkfk
primep
pprimep
pk
k
k1
1 2
1
2
12
2
)(So can be rewritten as:
where f and g are “related”
More generally, is the partial sum function of theindicator function of the property “primeness”:
)(k
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Partial Sum Theorem• Given a sequence S of complex numbers s(k), let
be the sequence of partial sums of S.
• Given a function f, if certain convergence criteria are satisfied, then
where
(the partial tails of f) is a transform of f independent of s & t
11
)()()()(jk
jgjskfkt
jk
kfjg )()(
n
k
ksnt1
)()(
PARTIALSUMS OF s( j )
PARTIALTAILS OF f ( k )
(New)
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Partial Sum Functions
• Many sequences are partial sum functions:
n
k knH
1
1)( the harmonic function
n
ks
s
knH
1
)( 1)( generalized harmonic function
n
kn
n
1 2
121
n
k
kn1
log)(log
n
kkn
knn
1
22
22
646
• Actually, every sequence is the partial sum function of some other sequence
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Some Partial Sum Transforms
ka
1
jk
kfjg )()()(kf )( jg)(kf
1)1(
1 jaa
kk 2
1
j
1
kk 3
1
)1(2
1
jj
!
1
k
)(
)1,(1
j
je
)!2(
12
k
kk
)!1( jj
ka
ksin 1cos21
sin)1sin(21 aaa
jajj
n
i ik0 )(
11
1
11 ),()1(
1
1
n
i
ii jinSn
1
)1(2 k
k
)1(2
)1(
jj
j
kak
1
0,,1
ja
k
k21
¼½,,1,1)½(4
)(12
jjFj
jj
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Some Partial Sum Transforms
1
1)(
kka
kt
1
)()(j
jgjs
1
)()(k
kfkt
11)1(
1)(
jjaa
js
12
1)(
k kkkt
1
1)(
j jjs
23
1)(
k kkkt
2 )1(2
1)(
j jjjs
1 !
1)(
k kkt
1 )(
)1,(1)(
j j
jejs
1
2
)!2(
1)(
k k
kkkt
1 )!1()(
j j
jjs
1
sin)(
kka
kkt
121 1cos21
sin)1sin()(
jj aaa
jajjs
1 0 )(
)(
k
n
i ik
kt
1
1
1
11 ),()1(
1
)(
j
n
i
ii jinSn
js
22 1
)1()(
k
k
kkt
2 )1(2
)1()(
j
j
jjjs
1
1)(
kkak
kt
1
0,,1
)(j
ja
js
1 21
)(k
k
kkt
112 ¼½,,1,1
)½(4
)()(
jj
jjFj
jjs
1
)()(j
jgjs
1
)()(k
kfkt
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
...00000
...00000
...)5()5(0000
...)5()4()4()4(000
...)5()3()4()3()3()3(00
...)5()2()4()2()3()2()2()2(0
...)5()1()4()1()3()1()2()1()1()1(
fs
fsfs
fsfsfs
fsfsfsfs
fsfsfsfsfs
Partial Sum Theorem (Proof)• Consider the upper triangular matrix :),()(, jijfism ji
HEADS OF s= t(i)
TAILS OF f= g(j)
Column sums are )()( kfkt
Rowsumsare
)()( jgjs
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Convergence Criteria
1. All sums g(k) converge
2. converges; and
3.
11
)()()()(kk
kgkskfkt iff
1
)()(k
kgks
0)()(lim
ngntn
Proof: By Markoff’s theorem on convergence of double series
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Further Applications• The number of perfect n
th powers k is
• The number of positive integers powers of a k is
• Therefore, by inspection,
1
111log
122
aankk
k
jj
aofpowerpositiveank
a
primepk ppkk
k
)1(
1)(2
23
)(11
112
mjnkk
k
jm
powermperfectank
m
th
n k
kalog
)2(log
)(1
1
)()12(
12
222
kk
k
pkk
kk
primep kk
* (Old)
primepk pk
kk
!
1
)!1(
)(
2
**
*
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Inverse Transform
• Given g(j), how can we find f(k)?
• Since g is a sum of f’s, f is the sequence of finite differences of g :
• Subtracting,
11
)()()()(jk
jgjskfkt
)1()(1
jgkfjk
)1()()( jgjgjf
)()( jgkfjk
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Some Inverse Transforms
aj
1
)( jg )1()()( kgkgkf )( jg )(kf
aa
aa
kk
kk
)1(
)1(
ja
11
1
ka
a
1
1
j )2)(1(
1
kk
!
1
j )!1( kk
!
1
jj )!1)(1(
12
kkk
kk
!!
1
jj )!1()!1(
22
kk
kk
)1(
)1(
jj
j
)2(
)1(2
kk
k
jaj
11)1(
kakk
akka
jF
1
1
1
kk
k
FF
F
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Some Inverse Transforms
1
1)(
jaj
js
1
)()(j
jgjs )()(1
kfktk
1 )1(
)1()(
kaa
aa
kk
kkkt
1
1)(
jja
js
11
1)(
kka
akt
1 1
1)(
j jjs
1 )2)(1(
)(
k kk
kt
1 !
)(
j j
js
1 )!1()(
k k
kkt
1 !
)(
j jj
js
1
2
)!1)(1(
1)(
k kkk
kkkt
1 !!
)(
j jj
js
1
2
)!1()!1(
2)(
k kk
kkkt
1 )1(
)1()(
j
j
jjjs
1 )2(
)()1(2
k
k
kk
kt
1
)(
jjaj
js
11)1(
)(k
kakk
akkakt
1
)(
j jF
js
1 1
1)(k kk
k
FF
Fkt
1
)()(j
jgjs )()(1
kfktk
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The Partial Integral Theorem• Given a function s(x), let t(y) be the “left integral” of s :
• Given a function f(y), if certain convergence criteria are satisfied, then
where
(the right integral of f) is a transform of f independent of s & t
dxxgxsdyyfyt
00
)()()()(
dxyfxgx
)()(
y
dxxsyt0
)()(
LEFT INTEGRAL OF s(x)
RIGHT INTEGRAL OF f ( y )
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Example
22 )1(
1)(;
1
1)(
xxf
xxs
Therefore,
02
02 )1)(1()1(
arctan
xx
dxdx
x
x
1
1)()(;arctan)()(
0
xdyyfxgydxxsyt
x
y
Note: if s(x) is a probability density
then t(y) is its cumulative distribution function
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Example
Consider the special case in which )()( xgxf
xexf )(
00
)()( dxexsdxext xxThis implies . So
1cos)1(1sin)1(2
1cosarctan
1 002
sicidxxedxx
e xx
1 2 3 4 5 6
0.2
0.4
0.6
0.8
1
xe x arctan
12
x
e x
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Example
xx eexxxtx
xs
2
1sinh;arcsinh)(;
1
1)(
2
???arcsinh0
dxxe x
580.75461002)1()1(21
00
02
YHdxx
e x
Bessel functionStruve function
What about Risch’s theorem? Risch, R. “The Solution of the Problem ofIntegration in Finite Terms.” Bull. Amer. Math. Soc., 1-76, 605-608, 1970.
Mathematica gives up.
Mathematica has no problem
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Discovery B
132
1 13
11)3()2(
)(
1
kj k kkjk
•
• Is there a general principle at work?
1 13)(
1
j k jkmust exceed ,
but by how much?
1)3(1
23
k k
)()1()(
1
1 1
ssjkj k
s
– In fact,
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Overcounting Functions
1. Every term of S+ occurs at least once in S.
2. In general, S+ overcounts S, since some terms of S occur many
times in S+
3. If Kg(k) is the number of times f(k) is included in S+, then
where Kg(k) depends only on g and not on f .
where ranges over the natural numbers),( jkg
1 11
)),(()(j kk
jkgfSkfS andLet ,
11 1
)()()),((k
gj k
kfkKjkgfS
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Examples
• Let g(k, j) = k + j . How many ordered pairs (k, j) of natural
numbers give k + j = n? Answer: Kk+j (n) = n - 1
• Therefore, by inspection,
)()1(111
)(
1
11
11 1
ssnnn
n
jk nss
ns
j ks
8)(
2
1
2
)( 2
11 1
nn
j kjk
nnjk
11!
1
)!(
1
11 1
een
n
jk nj k
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Examples
• Let g(k, j) = k • j . How many ordered pairs (k, j) give k • j = n?
Answer: Kk•j (n) = d(n), the number of divisors of n .
• Therefore, by inspection
)()(
)(
1 2
11 1
sn
nd
jk ns
j ks
1 11 1
)(
1
11
j nnj
j kjk a
nd
aa
...9076269794810610197.2!
)(
)!(
1
11 1
nj k n
nd
jk
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Enumerating Non-Trivial Powers• Let g(k, j) = k
j. How many ordered pairs (k, j) give k j = n?
Or, how many ways K(n) can n be expressed as a positive integral power of a positive integer?
• Let be the prime factorization of n
• n can be a non-trivial power of an integer > 1 iff
G(n) = gcd(e1, e2, . . . ) exceeds 1; otherwise K(n) = 1.
• Suppose b > 1 divides G(n). Then ,
where each of the ei /b is a natural number, so n is the b th power
of a natural number
• Suppose c > 1 does not divide G(n). Then at least one of the
exponents ei /c is not a natural number and n is not the c th power
of a natural number. Therefore,))nofionfactorizatprimetheofexponents(gcd()( dnK jk
...21
21ee ppn
bbebe ppn .../2
/1
21
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
A Remarkable Series
• Let . Then
s
nk
s
nk
knknKSS jj
11
)(1)(
ssss kkkk
11
1
12
111))(()(
22
22
nnn nnn
nGd
n
n
1)(1
2
sk
Sk
s
12 211 2
1)(1
1
)(
1
nk ks
j
sj
j ksj
snk
kk
S
22
2
1)(
nss
n
s
nnnnSS
...64
3
49
1
36
1
32
1
27
1
25
1
16
2
9
1
8
1
4
11
yields
the “overcounting” function
(Old)
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Goldbach’s Theorem
• In 1729, Christian Goldbach proved that
...26
1
24
1
15
1
8
1
7
1
3
11
1
1
powerintegertrivialnonaq
q
1)(1
1
1
powerintegertrivialnonaq 1 1
powerintegertrivialnonaq
k kk k
k
42 43 44
256
3
. . .
82
162
83
163
...64
3
49
1
36
1
32
1
27
1
25
1
16
2
9
1
8
1
4
11
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Discovery C
1
powerintegertrivialnonaq
1)(11
1
k
kq
???1
powerintegertrivialnonaq q
(Old)
What is
... 94049448666.8744643681)()(1
2powerinteger
trivialnonaq
k
kkq
2
powerintegertrivialnonaq
1)()(1)1(
1
k
kkqq
factorprimerepeatedahask
primesdistinctnofproductak
k
k n
,0
,)1(
1,1
)(
*
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Discovery D
primepp
kk
k
12
1
2
)(
1
• Since the partial sum function of is
, where is the number of distinct prime factors of k)(k
1
)1(112
kkk
k
aaa
aa
1,1
)(
1
1)(
1112
1
aaaa
ak
aa
k
kkkk
k
primepp
kk
1
1
ka
*
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Discovery E
11 1
)(1
kpk
jp c
pk
cj
For c > 1 real and p prime,
112 14
)2(
2
1
kk
j
kj
In particular,
0
21
2
112
112 2
1
2
log
12
)12(
12
)2(
2
1
kkk
kk
kk
jkj
kkk
11 14
)2(1
12
)2(1
kk
kk
kk
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Results
32
12
2
1
11 1),max(
kk
k jjk
k
The counting function Kmax(n) of max(k, j) is 2n-1. So
1!
12
)!,max(
1
11 1
ek
k
jk kk j
)3(3
12
),max(
1 2
13
1 13
kk j k
k
jk
The counting function Klcm(n) of lcm(k, j) is d(n 2). So
)2(
)()(
),(lcm
1 3
1
2
1 1 a
s
k
kd
jk ka
k js
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
The First-Digit Phenomenon
• Given a random integer, what is the probability that its leading digit is a 1?
• Answer: depends on the distribution from which k is chosen
• If k is chosen uniformly in [1, n], then let p(d, n) be the probability that the leading digit of k is d
• For n = 19+, 5/9 < p(1,n) < .579; 1/19 p(9,n) < 1/18
• For n = 9+, p(1,n) = 1/9; p(9,n) = 1/9
• The “average” is log10(1+1/d)
• {.301, .176, .124, .097, .079, .066, .058, .051, .046}
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Relative Digit Frequency (Benford’s Law)
0
0.05
0.1
0.15
0.2
0.25
0.3
0.35
1 2 3 4 5 6 7 8 9
Benford
log10(1+1/d)
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Relative Digit Frequency
0
0.05
0.1
0.15
0.2
0.25
0.3
0.35
1, 0 2, 1 3, 2 4, 3 5, 4 6, 5 7, 6 8, 7 9, 8 9
Benford
Catalog Frac
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
First-Digit Phenomenon
0
0.05
0.1
0.15
0.2
0.25
0.3
0.35
0, 1 1, 2 2, 3 3, 4 4, 5 5, 6 6, 7 7, 8 8, 9 9
Benford
Log[11,1+1/d]
Catalog Frac
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Major Ideas
• For mathematicians:– How to populate the catalog
– How to generalize from discoveries
• For computer scientists:– Use in symbolic manipulation systems
• For data miners:– How to mine the catalog, i.e. how to find new relations
• For statisticians:– How to use the fact that
where P is the cumulative distribution of density p
dxxgxpdyyfyP
00
)()()()(
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
A Parting Philosophy
“The object of mathematical rigor is to sanction and legitimize the conquests of intuition, and there was never any other object for it.”
Jacques Hadamard(as quoted by Borel in 1928)
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
QA&
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Results
2 22
1)1(
)()1(
)1(
)(
k k
k
k
k
kk
k
12 1 )12(
)(
2
1
12
)(
)(2
1
kk kk kk
k
k
k
k
)6(
)3()2(
)1(
11
)(
)(
2
primepk ppkk
k
222
1)1(
)(
)1(
)(
kk k
k
kk
k
22
2
)1(
)(1)(
kk kk
kdk
2
2)(1 log
)2()1(k
nnn
k
kn! is the nearest integer to
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Hypergometric Functions
• The are solutions of the hypergeometric differential equation:
!)(
)()(;;,
012 k
z
c
bazcbaF
k
k k
kk
0])1([)1( ybayzbacyzz
)(/)()1(...)1()( akakaaaa k where
dttzttbcb
czcbaF abcb
1
0
112 )1()1(
)()(
)(;;,
zcbaF ;;,12
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Partial Sum Theorem (Proof)
• Consider the upper triangular matrix
• The sum of row i is
• The sum of column j is
• The sum of the row sums equals the sum of the columns sums
precisely when the conditions of Markoff’s theorem are satisfied.
QED
ijj
ji igisjfism )()()()(1
,
jijfism ji ),()(,
j
iiji jfjtisjfm
11, )()()()(
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SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
Correspondence with Plouffe
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Catalog Int
Benford
Log[11,1+1/d]
Catalog Frac
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
First-Digit Phenomenon
SOURCE: SIMON PLOUFFE
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
First Digit Frequency
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Catalog Int
Benford
Catalog Frac
MCGILL UNIVERSITY
SEPTEMBER 21, 2007
COPYRIGHT © 2007 MICHAEL I. SHAMOS
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Correspondence with Plouffe