# How many "good" graphs of size $n$ are there?

Let's a call a directed simple graph $G$ on $n$ labelled vertices good if every vertex has outdegree 1 and, when considered as if it were undirected, it is connected. How many good graphs of size $n$ are there?

Here's my work so far. Let's call this number $T(n)$. Clearly, $T(2) = 1$: there's only the loop on two vertices. We also have that $T(3) = 8$. We can count them using the following argument: let's call a possible shape a directed simple graph on $n$ unlabelled vertices which is good. For $n = 3$ we have the following shapes: There are $3!$ labelled good graphs of the first shape: fix the outside vertex in 3 possible ways, then fix the loop in two possible ways. There are also $\frac{3!}{3}$ labelled good graphs of the second shape: it's simply the number of cycles on 3 elements. So in total we have: $$T(3) = 3! + \frac{3!}{3} = 8\text{.}$$

We also know that $T(4) = 78$. Let's list all possible shapes: From top left to bottom right, it's easy to check that we have $4!$ labelled good graphs of the first shape, $2\cdot {4 \choose 2}$ of the second, $2\cdot {4 \choose 2}$ of the third, $4!$ of the fourth and $\frac{4!}{4}$ of the last. In total: $$T(4) = 4! + \left(2\cdot {4 \choose 2} + 2\cdot {4 \choose 2}\right) + 4! + \frac{4!}{4} = 3\cdot 4! + \frac{4!}{4}\text{.}$$

I think that $T(5) = 884$, but I won't draw all possible shapes or count their labelings for brevity.

I computed $T(5)$ again, and now I get 944. This also invalidates the following conjecture.

CONJECTURE [DISPROVEN]: I'm conjecturing that there's a simple-ish formula for $T(n)$. It's something like $$T(n) = (2^{n-2} - 1) \cdot n! + \frac{n!}{n} + S(n)$$ where $S(n)$ is some function I currently don't understand such that $S(2) = S(3) = S(4) = 0$, while $S(5) = 5\cdot 4$.

• I think this could be rephrased as "How many functions are there from an $n$ element set to itself which have no fixed points, and under which all orbits coalesce" Dec 17, 2014 at 3:26
• Ah, yes, while writing this question I learned that this kind of graph is called a "functional graph" (en.wikipedia.org/wiki/Pseudoforest#Graphs_of_functions) as it can be interpreted as a function. Dec 17, 2014 at 3:39

I would like to contribute some ideas even though I don't have as much time as I'd like at the moment. If I understand this problem correctly then the class of graphs under consideration call it $\mathcal{Q}$ is in a set-of relationship with the class of endofunctions call it $\mathcal{E}$ with the latter being sets of the former.

The following MSE link A has closely related material, as does this MSE link B where aspects of "Random Mapping Statistics" by Flajolet and Odlyzko are discussed.

This gives the species equation $$\def\textsc#1{\dosc#1\csod} \def\dosc#1#2\csod{{\rm #1{\small #2}}} \mathcal{E} = \textsc{SET}(\mathcal{Q})$$ which is in terms of generating functions $$E(z) = \exp Q(z) \quad\text{or}\quad Q(z) = \log E(z).$$

Recall the popular labeled rooted tree function which represents the species $$\mathcal{T} = \mathcal{Z} \times \textsc{SET}(\mathcal{T})$$ and has the functional equation $$T(z) = z \exp T(z).$$

We also have that $$T(z) = \sum_{n\ge 1} n^{n-1} \frac{z^n}{n!}$$ (Cayley's formula) and since there are $n^n$ endofunctions we obtain $$E(z) = 1 + z\frac{d}{dz} T(z) = 1 + z T'(z).$$

But from the functional equation we get $$T'(z) = \exp T(z) + z \exp T(z) T'(z) = \frac{T(z)}{z} + T(z) T'(z)$$ so that $$T'(z) = \frac{1}{z} \frac{T(z)}{1-T(z)}.$$

This finally yields $$E(z) = 1 + \frac{T(z)}{1-T(z)}$$ and hence $$Q(z) = \log\left(1+\frac{T(z)}{1-T(z)}\right).$$

This gives the sequence $$1, 3, 17, 142, 1569, 21576, 355081, 6805296, \\ 148869153, 3660215680,\ldots$$ which points us to OEIS A001865 where we learn that indeed we have the right exponential generating function. Note that the formula for $E(z)$ also proves that $\mathcal{E} = \textsc{SEQ}(\mathcal{T}).$

Now to extract coefficients from this for a closed formula we expand the logarithm to get for the count $q_n$ the formula

$$n! [z^n] \sum_{k\ge 1} \frac{(-1)^{k+1}}{k} \left(\frac{T(z)}{1-T(z)}\right)^k.$$

Observe that we can restrict this to $k\le n$ because the tree function term starts at $z,$ getting $$n! [z^n] \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \left(\frac{T(z)}{1-T(z)}\right)^k.$$

We still need the terms of the fraction in the tree function, which can be done by Lagrange inversion. We have $$[z^n] \left(\frac{T(z)}{1-T(z)}\right)^k = \frac{1}{2\pi i} \int_{|z|=\epsilon} \frac{1}{z^{n+1}} \left(\frac{T(z)}{1-T(z)}\right)^k \; dz.$$

Put $T(z) = w$ so that $z=w/\exp(w)=w\exp(-w)$ and $dz=(\exp(−w)−w\exp(−w))\; dw$ to get $$\frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(w(n+1))}{w^{n+1}} \left(\frac{w}{1-w}\right)^k (\exp(−w)−w\exp(−w))\; dw \\ = \frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(wn)}{w^{n+1-k}} \frac{1}{(1-w)^{k-1}} \; dw .$$

Extracting the residue at zero yields for $k\ge 2$ $$\sum_{q=0}^{n-k} \frac{n^{n-k-q}}{(n-k-q)!} {q+k-2\choose k-2}$$ and for $k=1,$ $$\frac{n^{n-1}}{(n-1)!}.$$

Collecting these into one formula finally yields $$n^n + n! \sum_{k=2}^n \frac{(-1)^{k+1}}{k} \sum_{q=0}^{n-k} \frac{n^{n-k-q}}{(n-k-q)!} {q+k-2\choose k-2}.$$

This computation is closely related to the material at this MSE link.

Addendum. I just noticed in one of the other posts that fixed points are not admitted in those endofunctions. The above material admits fixed points as in the discussion and the diagram at the Wikipedia entry.

Addendum Thu Dec 18 19:57:09 CET 2014. The case when there are no fixed points goes as follows. There are now $(n-1)^n$ endofunctions with no fixed points, which gives $$E(z) = 1 + \sum_{n\ge 1} (n-1)^n \frac{z^n}{n!}.$$

Now observe that when we apply Lagrange inversion to $$\frac{\exp(-T(z))}{1-T(z)}$$ we obtain

$$[z^n] \frac{\exp(-T(z))}{1-T(z)} = \frac{1}{2\pi i} \int_{|z|=\epsilon} \frac{1}{z^{n+1}} \frac{\exp(-T(z))}{1-T(z)}\; dz$$

which using the same substitution as before becomes $$\frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(w(n+1))}{w^{n+1}} \frac{\exp(-w)}{1-w} (\exp(−w)−w\exp(−w))\; dw \\ = \frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(w(n-1))}{w^{n+1}}\; dw = \frac{(n-1)^n}{n!}.$$ But $\exp(-T(z)) = \frac{z}{T(z)}$ and we finally get for $E(z)$ the closed form $$\frac{z}{T(z)(1-T(z))}.$$

This gives for $Q(z)$ that $$Q(z) = \log\left(\frac{z}{T(z)(1-T(z))}\right)$$ (note that $E(z)$ has a constant term in its expansion at zero which is one) which produces the sequence $$0, 1, 8, 78, 944, 13800, 237432, 4708144, 105822432, 2660215680, \\ 73983185000, 2255828154624,\ldots$$ which points us to OEIS A000435, confirming the result from the accepted answer. Note that the OEIS says that this sequence was the first in the database, so we are content to be referencing it in this computation.

To get a closed form re-write $Q(z)$ as follows: $$Q(z) = \log\left(1 + \frac{z}{T(z)(1-T(z))} -1\right)$$ to get the formula $$n! [z^n] \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \left(\frac{z}{T(z)(1-T(z))} -1\right)^k$$ This is $$n! [z^n] \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \sum_{q=0}^k {k\choose q} (-1)^{k-q} \left(\frac{z}{T(z)(1-T(z))}\right)^q.$$ We can drop the term for $q=0$ when $n\ge 1,$ getting $$n! [z^n] \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \sum_{q=1}^k {k\choose q} (-1)^{k-q} \left(\frac{z}{T(z)(1-T(z))}\right)^q.$$

Use Lagrange inversion to extract coefficients from the tree function term. $$[z^n] \left(\frac{z}{T(z)(1-T(z))}\right)^q = \frac{1}{2\pi i} \int_{|z|=\epsilon} \frac{1}{z^{n+1}} \left(\frac{z}{T(z)(1-T(z))}\right)^q \; dz$$

which using the same substitution as before becomes $$\frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(w(n+1-q))}{w^{n+1-q}} \left(\frac{1}{w(1-w)}\right)^q (\exp(−w)−w\exp(−w))\; dw \\ = \frac{1}{2\pi i} \int_{|w|=\epsilon} \frac{\exp(w(n-q))}{w^{n+1}} \frac{1}{(1-w)^{q-1}} \; dw$$

Extracting coefficients we get $$\sum_{p=0}^n \frac{(n-q)^{n-p}}{(n-p)!} {p+q-2\choose q-2}$$ when $q\ge 2$ and for $q=1$ $$\frac{(n-1)^n}{n!}.$$

Substituting this into the sum formula yields $$n! \times \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \times k \times (-1)^{k-1} \frac{(n-1)^n}{n!} \\ + n! \times \sum_{k=1}^n \frac{(-1)^{k+1}}{k} \sum_{q=2}^k {k\choose q} (-1)^{k-q} \sum_{p=0}^n \frac{(n-q)^{n-p}}{(n-p)!} {p+q-2\choose q-2}.$$ This simplifies to $$n\times (n-1)^n + n! \times \sum_{k=2}^n \frac{(-1)^{k+1}}{k} \sum_{q=2}^k {k\choose q} (-1)^{k-q} \sum_{p=0}^n \frac{(n-q)^{n-p}}{(n-p)!} {p+q-2\choose q-2}.$$

This formula can be used to compute the count of these graphs for large $n$ where the tree function formula would no longer be practicable.

The sequence for $n=30$ to $n=34$ reads

38086159100543376291945674612050231296000000,
3117962569860399657478478640723143576082043800,
263711778692997479722657378560127779200642842624,
23019602620026625886784119896351926037410391377792,
2071846675499818842878197235287956993753027358752768


Additional observations. The OEIS entry OEIS A000435 says that this sequence is the normalized total height of all labeled rooted trees on $n$ nodes (sum of height of all nodes in all trees scaled by $n$). The question arises on how to prove this.

The height parameter is represented by the bivariate generating function $T(z, u)$ where $T(z, 1) = T(z)$ (the ordinary tree function) and we have the functional equation

$$T(z, u) = z + z\frac{T(uz,u)^1}{1!} + z\frac{T(uz,u)^2}{2!} + z\frac{T(uz,u)^3}{3!} + z\frac{T(uz,u)^4}{4!} + \cdots$$ or $$T(z, u) = z \exp T(uz, u).$$

The exponential generating function for the sum of the height of all nodes of all rooted labeled trees by the number of nodes is given by $$G(z) = \left.\frac{\partial}{\partial u} T(z, u)\right|_{u=1}.$$

We thus differentiate the functional equation, getting $$G(z) = \left. z \exp T(uz, u) \left(z \frac{\partial}{\partial z} T(z, u) + \frac{\partial}{\partial u} T(z, u) \right)\right|_{u=1}$$ which becomes $$G(z) = T(z) (z T'(z) + G(z))$$ so that $$G(z) (1-T(z)) = z T(z) T'(z)$$ or $$G(z) = \frac{z T(z)}{1-T(z)} T'(z).$$

We may substitute the expression for the derivative of the tree function that we obtained earlier into this to get $$G(z) = \frac{z T(z)}{1-T(z)} \frac{1}{z} \frac{T(z)}{1-T(z)} = \left(\frac{T(z)}{1-T(z)}\right)^2.$$

We have computed the exponential generating function of the total height of all labelled trees on $n$ nodes, which gives the sequence $$0, 2, 24, 312, 4720, 82800, 1662024, 37665152, 952401888, \\ 26602156800, 813815035000$$ which is OEIS A001864.

The normalized height is this sequence divided by $n.$ To verify that this is indeed the same as the count of endofunctions with no fixed point we must show that $$z \frac{d}{dz} Q(z) = G(z)$$ i.e. that the endofunctions times $n$ give the total height or alternatively, the total height divided by $n$ give the endofunctions.

But the left is $$z \frac{T(z)(1-T(z))}{z} \\ \times \left(\frac{1}{T(z)(1-T(z))} - z \frac{1-2T(z)} {T(z)^2 (1-T(z))^2} T'(z) \right)$$ which gives $$1- z \frac{1 - 2T(z)}{T(z)(1-T(z))} T'(z) = 1- \frac{1 - 2T(z)}{T(z)(1-T(z))} \frac{T(z)}{1-T(z)} = 1- \frac{1 - 2T(z)}{(1-T(z))^2} \\ = \frac{1-2T(z)+T(z)^2 -(1- 2T(z))}{(1-T(z))^2} = \left(\frac{T(z)}{1-T(z)}\right)^2,$$ thus concluding the proof.

• Thank you for your answer. I really wish I could follow it, but I'm losing you right at the beginning when you write $\mathcal{E} = \mathfrak{P}(\mathcal{Q})$. What's the meaning of $\mathfrak{P}$? Dec 18, 2014 at 2:58
• The history of this method including of course the work by Flajolet and Sedgewick and the notation are documented at this Wikipedia entry. Dec 18, 2014 at 20:24
• Thank you very much for the Additional observations paragraph! I was thinking of submitting another question asking "Why are those two quantities equal?". Dec 21, 2014 at 18:30
• I enjoyed working on this interesting question. I hope it finds its set of careful, dedicated readers given that the volume of the traffic at MSE is considerable and individual posts that are only moderately popular can disappear from the radar quite easily. Dec 21, 2014 at 18:36
• stellar answer. If I could give it a +2, I would. Aug 18, 2015 at 20:59

My solution does not agree with your answer for $T(5)$, but let's give it a try anyway . . .

To construct such a graph on $n$ vertices, consider the vertices with indegree $0$. If there are none of these then the graph is a (directed) cycle, and there are $(n-1)!$ possibilities. If there are $k$ specified vertices with indegree $0$, then we obtain our graph by choosing a graph of the required type on $n-k$ vertices, then deciding which of these $n-k$ vertices are to be the targets of the edges from the $k$ vertices of indegree $0$. The number of possibilities is $T(n-k)(n-k)^k$. Now the maximum value of $k$ is $n-2$ (can't be $n-1$ because then the remaining vertex would have to be adjacent to itself, which you do not allow). Therefore, by inclusion/exclusion, we have $$T(n)=(n-1)!+\sum_{k=1}^{n-2}(-1)^{k-1}\!\!\binom nk T(n-k)(n-k)^k\ .$$ The initial value is $T(2)=1$, and for $n=3,4,5$ this gives $8,78,944$.

My results seem to match OEIS A000435, though I can't see any connection with your problem.

• I wouldn't be surprised if I made some mistake calculating $T(5)$. I'd be much more surprised if your simpler (albeit recursive) formula matches the one by @jschnei! Dec 17, 2014 at 16:13
• According to my calculations on Maple, my formula matches jschnei's for $n=2,\ldots,20$. Not surprisingly, his takes much longer to calculate, about $240$ seconds comutation for the first $20$ values. Dec 18, 2014 at 1:45
• Ok, I uncovered a mistake in my enumeration for $T(5)$ and now I get 944 too. Dec 18, 2014 at 15:33
• I accepted this answer because it's the easiest to compute: just memoize the recursive calls to $T$. Dec 18, 2014 at 18:33

The graphs you are describing are known as simple (directed) pseudotrees; see http://en.wikipedia.org/wiki/Pseudoforest. There doesn't appear to be a 'nice' closed form for these trees. Wikipedia/OEIS gives the number of undirected connected graphs with $n$ vertices as

$$f(n) = \sum_{k=1}^n \frac{(-1)^{k-1}}{k} \sum_{n_1+\cdots+n_k=n} \frac{n!}{n_1! \cdots n_k!} \binom{\binom{n_1}{2}+\cdots +\binom{n_k}{2}}{n}.$$

(values at http://oeis.org/A057500).

Now, this is not quite what you want, since you want to count the number of such directed graphs. Luckily, these two quantities are easily related.

Note that every pseudotree can be decomposed into a directed cycle and several directed trees attached to points on this cycle. The edges in the directed trees must always point towards the cycle, so their direction is fixed given the undirected the graph. On the other hand, any cycle with more than two vertices can be directed in exactly two ways. Therefore, if $g(n)$ is the number of simple labelled directed pseudotrees (the quantity you want) and if $h(n)$ is the number of undirected pseudotrees with a cycle of size 2, then $g(n) = 2f(n) - h(n)$.

We can get an expression (although unfortunately not a closed form one) for $h(n)$ by observing that the number of ways to construct an undirected pseudotree with a cycle of size 2 is to choose 2 vertices to belong to the cycle, split the remanining vertices into 2 sets (depending on which vertex they belong to), and count the number of ways to build a labelled rooted forest on each of those sets. By Cayley's formula, there are $(n+1)^{n-1}$ rooted forests on $n$ labelled nodes, so this gives

$$h(n) = \binom{n}{2}\sum_{k=0}^{n-2}\binom{n-2}{k}(k+1)^{k-1}(n-k-1)^{n-k-3}$$

We can in fact generalize this logic to get a sum similar to that for $f(n)$ directly for $g(n)$; the only difference is that if our cycle is of length $k$, we must partition the remaining vertices into $k$ sets instead of 2. This gives

$$f(n) = \sum_{k=2}^{n}\binom{n}{k}(k-1)!\sum_{n_1+\cdots+n_{k}=n-k}\dfrac{(n-k)!}{n_1!\cdots n_k!}(n_1+1)^{n_1-1}\cdots(n_k+1)^{n_k-1}$$

• I'm not an expert at writing Maple so may have got something wrong, but your first $f(n)$ does not seem to match A057500. I think the initial $n$ should not be there? Dec 18, 2014 at 0:40
• Yes I think the initial $n$ should not be there; then $f$ agrees with both the values and formula given in A0575000 (I originally just copied the formula from Wikipedia, which has the same typo). Dec 18, 2014 at 5:39

Let $f(n)$ be what you want. Denote a graph acceptable if it's connected components (when viewed as an undirected graph) Are all good.(This is the same as saying it is of regular out-degree 1)

Then the number of acceptable graphs is $(n-1)^n$.

But we can also count the number of acceptable graphs by classifying on the number of vertices in the connected component of a special vertex (call it $v$).

We then arrive at the recursion $n(n-1)=\sum_{i=1}^n\binom{n-1}{i-1}f(i)(n-i-1)^{n-i}$.

So $f(n)=(n-1)^n-\sum_{i=1}^{n-1}f(i)\binom{n-1}{i-1}(n-i-1)^{n-i}$